3371 lines
146 KiB
YAML
3371 lines
146 KiB
YAML
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generator: ck2yaml
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input-files: [mythermo_si_halo.txt]
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cantera-version: 3.0.1
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date: Sun, 04 Aug 2024 13:54:38 +0000
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|
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units: {length: cm, time: s, quantity: mol, activation-energy: cal/mol}
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species:
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- name: B
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||
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composition: {B: 1}
|
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thermo:
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||
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model: NASA9
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||
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temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
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||
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data:
|
||
|
- [118.2394638, -0.0700991691, 2.500236159, -4.5842137e-07, 5.12318583e-10,
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||
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-3.057217674e-13, 7.533815325e-17, 6.84835908e+04, 4.20950192]
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||
|
- [-1.07265961e+05, 322.530716, 2.126407232, 2.106579339e-04, -5.93712916e-08,
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||
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7.37742799e-12, -2.282443381e-16, 6.6434131e+04, 6.87706967]
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||
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- [-4.15000131e+08, 2.329576796e+05, -47.2091371, 4.87765596e-03, -2.069413791e-07,
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||
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3.23351909e-12, -1.824076527e-18, -1.802904743e+06, 443.961764]
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note: Martin,J.M.L.,1998. Odintzova,1979. Gordon,1999. [g 9/98]
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- name: BBr
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||
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composition: {B: 1, Br: 1}
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thermo:
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model: NASA9
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temperature-ranges: [200.0, 1000.0, 6000.0]
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||
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data:
|
||
|
- [3.7960935e+04, -497.609602, 5.2670082, -3.74284019e-05, -1.13154437e-06,
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||
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1.261945702e-09, -4.28881188e-13, 3.038125367e+04, -4.35340733]
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||
|
- [2.536858027e+05, -640.59095, 4.66682347, 4.17548639e-04, -2.963714868e-07,
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||
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7.51911954e-11, -4.83536832e-15, 3.18908434e+04, -0.825587091]
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note: Gurvich,1996a pt1 p91 pt2 p70. [g 9/98]
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- name: BBr2
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composition: {B: 1, Br: 2}
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thermo:
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model: NASA9
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temperature-ranges: [200.0, 1000.0, 6000.0]
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||
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data:
|
||
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- [6.51655071e+04, -902.959076, 8.0638178, 1.12984901e-03, -4.19548239e-06,
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||
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3.96565877e-09, -1.283029835e-12, 1.470466408e+04, -13.36453164]
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||
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- [-4.19163337e+05, 415.768847, 7.14816983, -5.68959075e-04, 3.19544177e-07,
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-5.55317699e-11, 3.19113676e-15, 6118.98205, -5.50275962]
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note: Gurvich,1996a pt1 p92 pt2 p71. [g 9/98]
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- name: BBr3
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||
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composition: {B: 1, Br: 3}
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||
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thermo:
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model: NASA9
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temperature-ranges: [200.0, 1000.0, 6000.0]
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||
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data:
|
||
|
- [3.96807369e+04, -633.108716, 8.05455157, 9.7775713e-03, -1.614866025e-05,
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||
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1.216119883e-08, -3.51653961e-12, -2.366723308e+04, -11.0609939]
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||
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- [-1.901046795e+05, -150.3627687, 10.10999896, -4.32309511e-05, 9.40969619e-09,
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||
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-1.06521847e-12, 4.88304877e-17, -2.742553062e+04, -19.97496003]
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||
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note: Gurvich,1996a pt1 p93 pt2 p72. [tpis96]
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- name: BC
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composition: {B: 1, C: 1}
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thermo:
|
||
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model: NASA9
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temperature-ranges: [200.0, 1000.0, 6000.0]
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data:
|
||
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- [-3.915758e+04, 728.453806, -1.552743361, 0.01552898673, -1.976857863e-05,
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1.272066405e-08, -3.22998278e-12, 9.64491368e+04, 32.48204466]
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- [-2.346280674e+06, 6450.7513, -2.619532384, 3.3391605e-03, -4.50802214e-07,
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1.351919576e-11, 8.26510427e-16, 5.78668507e+04, 50.37884876]
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note: Gurvich,1996a pt1 p108 pt2 p86. [g 9/98]
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- name: BC2
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composition: {B: 1, C: 2}
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thermo:
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model: NASA9
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temperature-ranges: [200.0, 1000.0, 6000.0]
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data:
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||
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- [-2.987422175e+04, 364.312658, 2.963469415, 6.56175015e-03, -3.53976724e-06,
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1.927356029e-10, 3.118724866e-13, 9.30483573e+04, 10.83424193]
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- [1.525485889e+06, -5987.86238, 14.08384855, -3.7474998e-03, 1.081927223e-06,
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-1.378744645e-10, 6.473822e-15, 1.311204013e+05, -63.37215498]
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note: Gurvich,1996a pt1 p109 pt2 p87. [g 9/98]
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- name: BCL
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composition: {B: 1, Cl: 1}
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thermo:
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model: NASA9
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temperature-ranges: [200.0, 1000.0, 6000.0]
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data:
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||
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- [2.202458989e+04, -170.0511155, 3.066075869, 5.59507018e-03, -8.46087041e-06,
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6.08473341e-09, -1.702889433e-12, 2.197402537e+04, 6.388978917]
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- [-7.42126254e+04, 263.8090127, 3.60022765, 1.018866266e-03, -4.66618412e-07,
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9.84900203e-11, -6.46881817e-15, 1.91272648e+04, 5.235317877]
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note: Gurvich,1996a pt1 p73 pt2 p51. [g 9/98]
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- name: BCLOH
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composition: {B: 1, Cl: 1, O: 1, H: 1}
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thermo:
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model: NASA9
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temperature-ranges: [200.0, 1000.0, 6000.0]
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data:
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||
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- [-2.898427288e+04, 689.404658, -2.288138069, 0.0334942862, -4.72522598e-05,
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3.32698131e-08, -9.22423886e-12, -3.2619811e+04, 39.76886651]
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- [7.02773844e+05, -2857.391274, 10.9117584, -8.10770934e-05, -2.124440337e-08,
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5.40991244e-12, -3.46415384e-16, -1.307221888e+04, -35.85168799]
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note: Gurvich,1996a pt1 p83 pt2 p61. [g 9/98]
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- name: BCL(OH)2
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composition: {B: 1, Cl: 1, O: 2, H: 2}
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thermo:
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||
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model: NASA9
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||
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temperature-ranges: [200.0, 1000.0, 6000.0]
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||
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data:
|
||
|
- [8.07262301e+04, -859.461982, 2.705039614, 0.0387879962, -5.72173435e-05,
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||
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4.14585033e-08, -1.168536754e-11, -9.37991074e+04, 7.134982695]
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||
|
- [1.423878191e+06, -5849.70407, 17.92165219, -2.009909087e-04, -3.39343578e-08,
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||
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9.83856076e-12, -6.47267882e-16, -6.47426176e+04, -81.00399519]
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||
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note: Gurvich,1996a pt1 p85 pt2 p62. [tpis96]
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||
|
- name: BCL2
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||
|
composition: {B: 1, Cl: 2}
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||
|
thermo:
|
||
|
model: NASA9
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||
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temperature-ranges: [200.0, 1000.0, 6000.0]
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||
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data:
|
||
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- [3.59887942e+04, -360.28265, 4.15768545, 0.0115287745, -1.816567395e-05,
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1.341714418e-08, -3.84082286e-12, -6765.10705, 5.182311874]
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||
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- [3.50140313e+05, -1662.20359, 8.83953472, -9.77254411e-04, 2.467356248e-07,
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-2.501151018e-11, 8.72295456e-16, 568.290944, -21.48348344]
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note: Gurvich,1996a pt1 p74 pt2 p52. [tpis96]
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||
|
- name: BCL2OH
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composition: {B: 1, Cl: 2, O: 1, H: 1}
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||
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thermo:
|
||
|
model: NASA9
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||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
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||
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data:
|
||
|
- [2.09975517e+04, -247.0699169, 2.578761742, 0.03120362393, -4.54531405e-05,
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||
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3.24201177e-08, -9.03982266e-12, -7.30902862e+04, 12.73658611]
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||
|
- [5.87811379e+05, -2982.969317, 14.00662004, -1.194189832e-04, -1.269775742e-08,
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||
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4.42289219e-12, -3.004089365e-16, -5.82416807e+04, -51.50858228]
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||
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note: Gurvich,1996a pt1 p86 pt2 p63. [tpis96]
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||
|
- name: BCL3
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||
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composition: {B: 1, Cl: 3}
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||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.392970339e+04, -414.037886, 5.48803526, 0.01648395682, -2.456196216e-05,
|
||
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1.74387634e-08, -4.84522214e-12, -4.83946984e+04, -1.675355198]
|
||
|
- [-2.417408819e+05, -292.1539509, 10.2166848, -8.6236371e-05, 1.897792088e-08,
|
||
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-2.168726841e-12, 1.002154013e-16, -5.07483444e+04, -25.46862377]
|
||
|
note: Gurvich,1996a pt1 p76 pt2 p53. [tpis96]
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||
|
- name: BF
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||
|
composition: {B: 1, F: 1}
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||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.23895473e+04, 811.847664, -1.141614903, 0.01161249417, -1.175212617e-05,
|
||
|
6.01923278e-09, -1.238293129e-12, -1.774541998e+04, 30.05086287]
|
||
|
- [-3.74638978e+05, 560.449391, 3.60918611, 6.18721693e-04, -1.77893877e-07,
|
||
|
2.426601527e-11, -9.39465158e-16, -1.819179292e+04, 3.71660929]
|
||
|
note: Gurvich,1996a pt1 p56 pt2 p36. [g10/97]
|
||
|
- name: BFCL
|
||
|
composition: {B: 1, F: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.363512735e+04, 438.316898, 0.391809572, 0.01719990692, -2.139592424e-05,
|
||
|
1.337389186e-08, -3.37116469e-12, -3.68716659e+04, 26.68102752]
|
||
|
- [-1.086309561e+05, -523.343848, 7.29750474, -3.054410701e-05, -3.154598306e-08,
|
||
|
1.052290533e-11, -7.61543226e-16, -3.30589121e+04, -11.86586595]
|
||
|
note: Gurvich,1996a pt1 p86 pt2 p64. [tpis96]
|
||
|
- name: BFCL2
|
||
|
composition: {B: 1, F: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4402.55124, -157.1398929, 4.01632231, 0.01743396078, -2.25278906e-05,
|
||
|
1.433673443e-08, -3.64875558e-12, -7.82245262e+04, 6.886094746]
|
||
|
- [-2.233613309e+05, -644.060296, 10.47861848, -1.911892367e-04, 4.22488779e-08,
|
||
|
-4.84726692e-12, 2.247974725e-16, -7.74062648e+04, -28.14630564]
|
||
|
note: Gurvich,1996a pt1 p88 pt2 p66. [tpis96]
|
||
|
- name: BFOH
|
||
|
composition: {B: 1, F: 1, O: 1, H: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.56395367e+04, 1354.838128, -5.64821011, 0.0387027466, -5.03765918e-05,
|
||
|
3.33959264e-08, -8.84782295e-12, -6.19444611e+04, 58.0036282]
|
||
|
- [7.25131809e+05, -3215.62085, 11.17909777, -1.883881929e-04, 2.57970808e-09,
|
||
|
2.6651581e-12, -2.186647438e-16, -3.71680808e+04, -39.7846349]
|
||
|
note: Gurvich,1996a pt1 p71 pt2 p48. [g 9/98]
|
||
|
- name: BF(OH)2
|
||
|
composition: {B: 1, F: 1, O: 2, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.381800676e+04, 252.9637004, -3.84455204, 0.0525514085, -7.19311773e-05,
|
||
|
4.94830991e-08, -1.345922496e-11, -1.283123258e+05, 42.9365937]
|
||
|
- [1.42203764e+06, -6257.29757, 18.22460686, -3.22139645e-04, -7.1267399e-09,
|
||
|
6.75869977e-12, -5.04255454e-16, -9.18625419e+04, -85.2789505]
|
||
|
note: Gurvich,1996a pt1 p71 pt2 p49. [tpis96]
|
||
|
- name: BF2
|
||
|
composition: {B: 1, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-6.78765176e+04, 1085.903536, -3.023320961, 0.02326503687, -2.641444147e-05,
|
||
|
1.515620683e-08, -3.51855918e-12, -6.64091825e+04, 44.3196831]
|
||
|
- [-1.153091296e+05, -810.980012, 7.60270923, -2.409209242e-04, 5.32847186e-08,
|
||
|
-6.11879794e-12, 2.839984178e-16, -5.79622217e+04, -16.55644047]
|
||
|
note: Gurvich,1996a pt1 p58 pt2 p37. [tpis96]
|
||
|
- name: BF2CL
|
||
|
composition: {B: 1, F: 2, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4500.10125, -119.6284966, 3.19863514, 0.01743426933, -1.994070287e-05,
|
||
|
1.12513643e-08, -2.544020371e-12, -1.076779851e+05, 10.08195015]
|
||
|
- [-2.066817398e+05, -1024.447292, 10.75843981, -3.023235319e-04, 6.67252147e-08,
|
||
|
-7.6499419e-12, 3.5462245e-16, -1.046936725e+05, -32.29995036]
|
||
|
note: Gurvich,1996a pt1 p87 pt2 p65. [tpis96]
|
||
|
- name: BF2OH
|
||
|
composition: {B: 1, F: 2, O: 1, H: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7522.52165, 436.712169, -3.128973474, 0.0432395768, -5.78549404e-05,
|
||
|
3.88585813e-08, -1.038574523e-11, -1.344259458e+05, 41.3917055]
|
||
|
- [5.76075925e+05, -3611.90019, 14.4689764, -3.028293733e-04, 2.764337508e-08,
|
||
|
-1.90549317e-13, -8.69497194e-17, -1.133589041e+05, -58.9698151]
|
||
|
note: Gurvich,1996a pt1 p72 pt2 p50. [tpis96]
|
||
|
- name: BF3
|
||
|
composition: {B: 1, F: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3465.584, 21.33198651, 1.641245191, 0.01993755064, -2.15011993e-05,
|
||
|
1.145669081e-08, -2.442285789e-12, -1.379455591e+05, 16.25533544]
|
||
|
- [-1.819767014e+05, -1405.347931, 11.03412258, -4.10459105e-04, 9.03127757e-08,
|
||
|
-1.03305736e-11, 4.78055183e-16, -1.323136863e+05, -37.3838608]
|
||
|
note: Gurvich,1996a pt1 p62 pt2 p39. [tpis96]
|
||
|
- name: BH
|
||
|
composition: {B: 1, H: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.06308255e+04, -368.250252, 6.07133787, -8.72832107e-03, 1.458566459e-05,
|
||
|
-1.036840401e-08, 2.779462579e-12, 5.46045992e+04, -13.00392582]
|
||
|
- [-1.098531663e+06, -174.5890126, 8.44242681, -5.44019667e-03, 2.718307052e-06,
|
||
|
-4.83981221e-10, 2.868523222e-14, 5.01673567e+04, -29.71030686]
|
||
|
note: Bauschlicher,1990. Gurvich,1996a pt1 p28 pt2 p19. [g12/99]
|
||
|
- name: BHCL
|
||
|
composition: {B: 1, H: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4.76327491e+04, -442.001652, 3.97564588, 8.54169876e-03, -1.377785182e-05,
|
||
|
1.131521587e-08, -3.56965918e-12, 1.822278428e+04, 3.028452399]
|
||
|
- [3.49999172e+05, -2238.404757, 8.71110605, -1.088882906e-03, 4.18930109e-07,
|
||
|
-6.56871126e-11, 3.6200676e-15, 2.841240364e+04, -25.89566225]
|
||
|
note: Gurvich,1996a pt1 p81 pt2 p58. [g 9/98]
|
||
|
- name: BHCL2
|
||
|
composition: {B: 1, H: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4.41991481e+04, -238.4739577, 1.356682235, 0.02517866897, -3.6329104e-05,
|
||
|
2.644335581e-08, -7.62504411e-12, -3.003877914e+04, 17.87024616]
|
||
|
- [4.11099606e+05, -2858.027441, 11.79547506, -6.32281797e-04, 1.269551549e-07,
|
||
|
-1.352862344e-11, 5.92165351e-16, -1.61728876e+04, -42.17900972]
|
||
|
note: Gurvich,1996a pt1 p82 pt2 p60. [tpis96]
|
||
|
- name: BHF
|
||
|
composition: {B: 1, H: 1, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.90836226e+04, 961.076021, -2.919850316, 0.02149156633, -2.595677863e-05,
|
||
|
1.693492714e-08, -4.55364884e-12, -1.466925195e+04, 41.6070931]
|
||
|
- [1.1848213e+06, -4677.43518, 10.67328148, -1.606366598e-03, 3.7045347e-07,
|
||
|
-3.79788275e-11, 1.432441145e-15, 1.802640937e+04, -42.8593117]
|
||
|
note: Gurvich,1996a pt1 p68 pt2 p45. [g 9/98]
|
||
|
- name: BHFCL
|
||
|
composition: {B: 1, H: 1, F: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [576.116972, 304.215625, -0.980890036, 0.02803843648, -3.67673402e-05,
|
||
|
2.499824138e-08, -6.87342164e-12, -6.05020739e+04, 31.32842092]
|
||
|
- [4.39077892e+05, -3137.181709, 12.00286161, -7.15366934e-04, 1.453878608e-07,
|
||
|
-1.56519707e-11, 6.91007506e-16, -4.23236834e+04, -44.66542881]
|
||
|
note: Gurvich,1996a pt1 p90 pt2 p69. [tpis96]
|
||
|
- name: BHF2
|
||
|
composition: {B: 1, H: 1, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-8.35354028e+04, 1616.659766, -8.16140567, 0.0415378679, -4.92106328e-05,
|
||
|
3.054165306e-08, -7.78681398e-12, -9.74806546e+04, 70.3863075]
|
||
|
- [4.66087696e+05, -3728.10049, 12.44152658, -8.90684319e-04, 1.841732568e-07,
|
||
|
-2.010774349e-11, 8.97919659e-16, -6.97814293e+04, -51.0321804]
|
||
|
note: Gurvich,1996a pt1 p69 pt2 p47. [tpis96]
|
||
|
- name: BH2
|
||
|
composition: {B: 1, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.812557296e+04, -300.0083489, 4.824221, -2.186429819e-04, 1.485457398e-06,
|
||
|
3.89373968e-10, -6.33162939e-13, 3.99198842e+04, -5.04268285]
|
||
|
- [1.360117365e+06, -4917.70449, 9.75897103, -7.41587064e-04, 1.269760019e-07,
|
||
|
-1.187742442e-11, 4.68255251e-16, 6.89029266e+04, -41.9049012]
|
||
|
note: Jacox,1994. Kolbuszewski,1996. Gurvich,1996a p32. [g 2/00]
|
||
|
- name: BH2CL
|
||
|
composition: {B: 1, H: 2, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.646638117e+04, 127.7320942, 0.1300268921, 0.01938143193, -2.316389616e-05,
|
||
|
1.607896164e-08, -4.66833765e-12, -1.112112215e+04, 23.08500112]
|
||
|
- [1.427215437e+06, -6265.56434, 13.82183005, -1.313843556e-03, 2.587131606e-07,
|
||
|
-2.71384527e-11, 1.172827257e-15, 2.639387516e+04, -63.99725308]
|
||
|
note: Gurvich,1996a pt1 p82 pt2 p59. [tpis96]
|
||
|
- name: BH2F
|
||
|
composition: {B: 1, H: 2, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-8.83792044e+04, 1705.285929, -8.06124613, 0.0364318868, -4.15248255e-05,
|
||
|
2.620135756e-08, -6.93088641e-12, -4.78727341e+04, 68.6208767]
|
||
|
- [1.435082111e+06, -6625.32017, 14.09165008, -1.42246906e-03, 2.828724718e-07,
|
||
|
-2.992498948e-11, 1.302618926e-15, -793.719267, -68.013564]
|
||
|
note: Gurvich,1996a pt1 p69 pt2 p46. [tpis96]
|
||
|
- name: BH3
|
||
|
composition: {B: 1, H: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-6.61963507e+04, 1262.658391, -4.6543559, 0.02461795131, -2.501537437e-05,
|
||
|
1.562330756e-08, -4.32394948e-12, 5667.58798, 46.6650462]
|
||
|
- [1.85577895e+06, -8002.49237, 15.05692199, -1.790456689e-03, 3.6125111e-07,
|
||
|
-3.86603591e-11, 1.698508879e-15, 5.96753707e+04, -79.9404616]
|
||
|
note: Allendorf,1997. Jacox,1998 p212. Martin,J.M.L.,1992. [g 1/00]
|
||
|
- name: BH4
|
||
|
composition: {B: 1, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.734274578e+04, -84.7361938, 1.551871695, 0.01439765491, -6.11115236e-06,
|
||
|
-1.324417559e-10, 5.13300815e-13, 3.022048074e+04, 12.50358328]
|
||
|
- [1.354714146e+06, -7870.76275, 18.2617061, -1.948275329e-03, 4.07270689e-07,
|
||
|
-4.4827109e-11, 2.014115885e-15, 7.47024949e+04, -96.8608689]
|
||
|
note: Radical. Saxon,1993. Yu,1998. [g 5/00]
|
||
|
- name: BH5
|
||
|
composition: {B: 1, H: 5}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.60307536e+04, 1457.641959, -8.24503763, 0.0481747823, -5.5351047e-05,
|
||
|
3.57829959e-08, -9.7177575e-12, 3424.23893, 66.9588152]
|
||
|
- [2.472199159e+06, -1.110339842e+04, 22.43395706, -2.121632568e-03,
|
||
|
4.03899424e-07, -4.12191049e-11, 1.741706383e-15, 7.56174463e+04,
|
||
|
-124.3306259]
|
||
|
note: Schreiner,1994. [g 8/00]
|
||
|
- name: BH3NH3
|
||
|
composition: {B: 1, H: 6, N: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.811063598e+05, 3010.341543, -15.24271135, 0.0621563775, -5.95988185e-05,
|
||
|
3.26742936e-08, -7.75124309e-12, -2.934278877e+04, 108.7399608]
|
||
|
- [4.35492596e+06, -1.824235232e+04, 31.6299983, -3.20824361e-03, 5.88507545e-07,
|
||
|
-5.80853553e-11, 2.3825786e-15, 9.43811803e+04, -189.7865799]
|
||
|
note: Gurvich,1996a pt1 p106 pt2 p84. [tpis96]
|
||
|
- name: BI
|
||
|
composition: {B: 1, I: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.51744953e+04, -544.58193, 6.02751101, -2.387237926e-03, 2.244796277e-06,
|
||
|
-1.110001347e-09, 2.280204403e-13, 4.07191013e+04, -7.28804984]
|
||
|
- [2.132872626e+06, -6283.68496, 11.23964343, -3.25885675e-03, 7.06428215e-07,
|
||
|
-4.23006893e-11, -4.20807847e-16, 7.79763481e+04, -46.6404261]
|
||
|
note: Gurvich,1996a pt1 p94 pt2 p73. [g 9/98]
|
||
|
- name: BI2
|
||
|
composition: {B: 1, I: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [6.6409759e+04, -1044.411994, 9.73419724, -3.95255754e-03, 3.16556778e-06,
|
||
|
-1.273764644e-09, 1.879968132e-13, 3.20575089e+04, -20.12407058]
|
||
|
- [-3.92402223e+05, 442.290235, 7.12962358, -5.61963406e-04, 3.18076052e-07,
|
||
|
-5.53707972e-11, 3.1839597e-15, 2.291972638e+04, -3.20179324]
|
||
|
note: Gurvich,1996a pt1 p95 pt2 p74. [g 9/98]
|
||
|
- name: BI3
|
||
|
composition: {B: 1, I: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [6.24311489e+04, -1002.408628, 11.06650075, 1.609588058e-03, -5.14725025e-06,
|
||
|
4.73251402e-09, -1.512999796e-12, 5160.34815, -24.20687643]
|
||
|
- [-1.506176506e+05, -81.6721061, 10.05937867, -2.319396215e-05, 5.01996673e-09,
|
||
|
-5.65434963e-13, 2.580651348e-17, -426.168791, -16.17962779]
|
||
|
note: Gurvich,1996a pt1 p96 pt2 p75. [tpis96]
|
||
|
- name: BN
|
||
|
composition: {B: 1, N: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.56970758e+04, 670.428607, 0.0361508908, 7.33948751e-03, -4.96903349e-06,
|
||
|
1.22903138e-09, 6.34028152e-14, 6.48546508e+04, 25.39869896]
|
||
|
- [-2.276932705e+05, -102.5649298, 4.41458681, 2.561670989e-04, -1.612994942e-08,
|
||
|
-6.52605293e-13, 5.74946612e-17, 6.78446513e+04, -0.6778568656]
|
||
|
note: Gurvich,1996a pt1 p104 pt2 p83. [g 9/98]
|
||
|
- name: BO
|
||
|
composition: {B: 1, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [-1.166216822e+04, 92.1757939, 3.65549849, -3.11854292e-03, 9.00832983e-06,
|
||
|
-8.01778999e-09, 2.472952292e-12, 873.828478, 4.48284739]
|
||
|
- [1.788600589e+04, -630.901963, 4.5745284, 1.988001643e-04, -9.70296348e-08,
|
||
|
1.870854291e-11, -1.030218131e-15, 4841.31109, -3.39889058]
|
||
|
- [-1.592699514e+08, 1.210955629e+05, -31.36823502, 5.11003776e-03,
|
||
|
-3.46102074e-07, 1.148046833e-11, -1.504899225e-16, -9.34506576e+05,
|
||
|
302.6123907]
|
||
|
note: Gurvich,1996a pt1 p10 pt2 p8. [g 9/98]
|
||
|
- name: BOCL
|
||
|
composition: {B: 1, O: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7.05238064e+04, -1315.301429, 11.30087727, -0.0120711205, 1.880516131e-05,
|
||
|
-1.373823975e-08, 3.85489016e-12, -3.3553991e+04, -36.98462517]
|
||
|
- [1.557148487e+05, -1446.254968, 8.50944805, -3.85900738e-04, 8.26226882e-08,
|
||
|
-9.26102746e-12, 4.21999801e-16, -3.20358904e+04, -23.72713292]
|
||
|
note: Gurvich,1996a pt1 p79 pt2 p55. [tpis96]
|
||
|
- name: BOCL2
|
||
|
composition: {B: 1, O: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7322.66736, -202.7726965, 4.16192409, 0.01733309456, -2.263908718e-05,
|
||
|
1.45227519e-08, -3.71959312e-12, -4.41444188e+04, 6.52042411]
|
||
|
- [-2.297527041e+05, -619.456793, 10.46075518, -1.841620739e-04, 4.07121543e-08,
|
||
|
-4.67224655e-12, 2.167237536e-16, -4.37153842e+04, -27.43570215]
|
||
|
note: Gurvich,1996a pt1 p79 pt2 p56. [tpis96]
|
||
|
- name: BOF
|
||
|
composition: {B: 1, O: 1, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7.22680265e+04, -1131.38663, 8.81605452, -4.62769457e-03, 7.80129958e-06,
|
||
|
-5.68120584e-09, 1.534732094e-12, -6.71111601e+04, -25.47957229]
|
||
|
- [1.937020297e+05, -1739.112297, 8.69565086, -4.51889557e-04, 9.59101908e-08,
|
||
|
-1.067806769e-11, 4.84000766e-16, -6.33015239e+04, -27.02458617]
|
||
|
note: Gurvich,1996a pt1 p65 pt2 p42. [tpis96]
|
||
|
- name: BOF2
|
||
|
composition: {B: 1, O: 1, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7227.79413, 21.48783624, 1.157840301, 0.02250585296, -2.610731536e-05,
|
||
|
1.508824929e-08, -3.51836485e-12, -1.013995733e+05, 20.10127136]
|
||
|
- [-2.205028861e+05, -1254.23869, 10.9255138, -3.680144e-04, 8.10716494e-08,
|
||
|
-9.28127506e-12, 4.2975493e-16, -9.68044758e+04, -34.8285333]
|
||
|
note: Gurvich,1996a pt1 p66 pt2 p43. [tpis96]
|
||
|
- name: BOH
|
||
|
composition: {B: 1, O: 1, H: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.52141027e+04, 1391.444703, -5.63033018, 0.02966358811, -3.83083518e-05,
|
||
|
2.550606424e-08, -6.79585721e-12, -8341.30028, 55.1769004]
|
||
|
- [8.44749857e+05, -3016.982887, 8.0838647, -1.609855388e-04, -2.191830959e-09,
|
||
|
3.127133119e-12, -2.376665451e-16, 1.647698495e+04, -26.03227947]
|
||
|
note: Gurvich,1996a pt1 p41 pt2 p24. [tpis96]
|
||
|
- name: BO2
|
||
|
composition: {B: 1, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.14109064e+04, 719.885461, -1.477629435, 0.02277415194, -2.786326934e-05,
|
||
|
1.718462069e-08, -4.27899144e-12, -4.17765769e+04, 32.5845801]
|
||
|
- [-3.83445234e+04, -956.326114, 8.20096278, -2.062130802e-04, 9.87228899e-09,
|
||
|
8.15836676e-12, -7.52751966e-16, -3.42356402e+04, -22.24772278]
|
||
|
note: Gurvich,1996a pt1 p14 pt2 p11. [g10/97]
|
||
|
- name: B(OH)2
|
||
|
composition: {B: 1, O: 2, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1491.659222, 364.818484, -2.906006389, 0.0413683446, -5.78258422e-05,
|
||
|
4.06978356e-08, -1.126499791e-11, -5.37548366e+04, 38.8853518]
|
||
|
- [1.557023406e+06, -5784.71076, 14.87391235, -1.821804765e-04, -3.80354164e-08,
|
||
|
1.030332746e-11, -6.68588983e-16, -1.806810301e+04, -65.902689]
|
||
|
note: Gurvich,1996a pt1 p46 pt2 p28. [g 9/98]
|
||
|
- name: B2
|
||
|
composition: {B: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.516418096e+05, 2630.168946, -13.81358321, 0.0521622519, -6.93049474e-05,
|
||
|
4.46941039e-08, -1.128496456e-11, 8.99525105e+04, 98.1311849]
|
||
|
- [1.094594495e+06, -2602.735739, 6.90945621, -6.40594989e-04, 1.951732355e-07,
|
||
|
-2.555902119e-11, 1.053557323e-15, 1.187807611e+05, -19.49045025]
|
||
|
note: Gurvich,1996a pt1 p8 pt2 p7. [g 9/98]
|
||
|
- name: B2C
|
||
|
composition: {B: 2, C: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.16651987e+04, 579.777952, 1.411017091, 0.01174705713, -1.066474425e-05,
|
||
|
4.71723262e-09, -7.97001326e-13, 9.1968742e+04, 17.69254387]
|
||
|
- [1.159241019e+06, -4567.79881, 12.28672097, -2.500830701e-03, 6.40997985e-07,
|
||
|
-6.93293577e-11, 2.672933741e-15, 1.222442137e+05, -51.99066186]
|
||
|
note: Gurvich,1996a pt1 p110 pt2 p88. [g 9/98]
|
||
|
- name: B2CL4
|
||
|
composition: {B: 2, Cl: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4.28555513e+04, -728.074881, 9.31576367, 0.02331629623, -3.51124761e-05,
|
||
|
2.464057658e-08, -6.73547996e-12, -5.81902324e+04, -16.22083878]
|
||
|
- [-6.42798703e+05, 507.856299, 14.86725022, 2.026983515e-06, 6.27271881e-09,
|
||
|
-1.218822573e-12, 7.24120841e-17, -6.820066e+04, -41.39110669]
|
||
|
note: Gurvich,1996a pt1 p77 pt2 p54. [g10/97]
|
||
|
- name: B2F4
|
||
|
composition: {B: 2, F: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.97169564e+04, 818.942544, -0.643767129, 0.0385896607, -4.31305319e-05,
|
||
|
2.404463223e-08, -5.39355935e-12, -1.790041225e+05, 35.5217997]
|
||
|
- [3.85586589e+04, -2928.842655, 17.92063736, -9.52399827e-04, 1.614708845e-07,
|
||
|
-1.428613504e-11, 5.21873967e-16, -1.613051924e+05, -71.8480325]
|
||
|
note: Gurvich,1996a pt1 p64 pt2 p41. [g10/97]
|
||
|
- name: B2H
|
||
|
composition: {B: 2, H: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8.77557974e+04, -1343.931564, 9.83209915, -5.60713775e-03, 5.73065105e-06,
|
||
|
-2.266436197e-09, 1.97235208e-13, 1.009908698e+05, -32.8246148]
|
||
|
- [6.17554575e+05, -2627.897466, 9.08490507, -5.38941833e-04, 1.0507147e-07,
|
||
|
-1.092459556e-11, 4.68485466e-16, 1.099537555e+05, -31.6402991]
|
||
|
note: Adams,1989. Yu,1998. [g 7/00]
|
||
|
- name: B2H2
|
||
|
composition: {B: 2, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.421617322e+05, -2138.011262, 13.17732399, -8.94265807e-03, 1.127804935e-05,
|
||
|
-5.7878862e-09, 1.000813871e-12, 6.37231925e+04, -53.4698274]
|
||
|
- [1.240614592e+06, -5368.96502, 13.79292454, -1.136749748e-03, 2.245617156e-07,
|
||
|
-2.361530467e-11, 1.022604572e-15, 8.50651149e+04, -64.354613]
|
||
|
note: Curtiss,1989a. Yu,1998. [g 7/00]
|
||
|
- name: B2H3
|
||
|
composition: {B: 2, H: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [9.42514716e+04, -1075.866284, 6.38399939, 0.01167858327, -1.429661252e-05,
|
||
|
1.128776882e-08, -3.68132506e-12, 4.63533508e+04, -14.00002845]
|
||
|
- [1.771506902e+06, -7872.26093, 17.89447015, -1.709304785e-03, 3.40957543e-07,
|
||
|
-3.61454368e-11, 1.575671409e-15, 8.73771189e+04, -90.5462946]
|
||
|
note: Adams,1989. Yu,1998. [g 6/00]
|
||
|
- name: B2H3,db
|
||
|
composition: {B: 2, H: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [6.06401484e+04, -752.446633, 5.58448384, 0.01080468494, -8.64903281e-06,
|
||
|
4.74833331e-09, -1.309096028e-12, 4.4917923e+04, -8.87368682]
|
||
|
- [1.497731017e+06, -7219.31414, 17.50463766, -1.5796988e-03, 3.16410347e-07,
|
||
|
-3.36722515e-11, 1.472919654e-15, 8.32434967e+04, -87.7954926]
|
||
|
note: 2-Bridges. Adams,1989. Yu,1998. [g 7/00]
|
||
|
- name: B2H4
|
||
|
composition: {B: 2, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4.0001323e+04, -307.1548876, 1.763071673, 0.02646361882, -3.066168202e-05,
|
||
|
2.163781936e-08, -6.49183541e-12, 2.581033714e+04, 10.1526713]
|
||
|
- [2.292078842e+06, -1.059832517e+04, 22.68612155, -2.363586598e-03,
|
||
|
4.76217307e-07, -5.0901004e-11, 2.23391159e-15, 8.63859198e+04, -124.6794566]
|
||
|
note: 1-Bridge. Ruscic,1989b. Curtiss,1989b. [g 8/00]
|
||
|
- name: B2H4,db
|
||
|
composition: {B: 2, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.781496923e+04, 571.604804, -2.763085348, 0.03125348696, -2.709524346e-05,
|
||
|
1.341728634e-08, -3.004352798e-12, 2.158138307e+04, 36.7587294]
|
||
|
- [1.886854256e+06, -1.010045614e+04, 22.47110812, -2.319968667e-03,
|
||
|
4.73187996e-07, -5.11067303e-11, 2.262693782e-15, 8.233487e+04, -123.7455797]
|
||
|
note: 2-Bridges.Ruscic,1989b. Curtiss,1989b. [g 7/00]
|
||
|
- name: B2H5
|
||
|
composition: {B: 2, H: 5}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.83096545e+04, -40.6614805, -1.422523787, 0.0367459527, -3.85198971e-05,
|
||
|
2.44449444e-08, -6.82172294e-12, 3.008956452e+04, 28.02425895]
|
||
|
- [2.696691012e+06, -1.320019835e+04, 27.35260413, -2.961879012e-03,
|
||
|
5.98499943e-07, -6.41374855e-11, 2.821187823e-15, 1.064524901e+05,
|
||
|
-155.9654379]
|
||
|
note: 1-Bridge. Ruscic,1989a. Trachtman,1990. [g 5/00]
|
||
|
- name: B2H5,db
|
||
|
composition: {B: 2, H: 5}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.424446027e+04, 420.45582, -3.70045125, 0.036720531, -3.19350373e-05,
|
||
|
1.695013434e-08, -4.25703814e-12, 3.046684683e+04, 42.4549582]
|
||
|
- [2.571729448e+06, -1.356829858e+04, 27.81376038, -3.19236503e-03,
|
||
|
6.56116526e-07, -7.12733394e-11, 3.16949265e-15, 1.106370527e+05,
|
||
|
-159.7214457]
|
||
|
note: 2-Bridges. Ruscic,1989a. Trachtman,1990. [g 5/00]
|
||
|
- name: B2H6
|
||
|
composition: {B: 2, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.052844558e+04, 1041.795556, -8.96051886, 0.0549248088, -5.30519705e-05,
|
||
|
3.011904756e-08, -7.6887683e-12, -925.937435, 68.1259243]
|
||
|
- [2.835765414e+06, -1.567600163e+04, 32.2612233, -3.73860973e-03, 7.71880646e-07,
|
||
|
-8.41445454e-11, 3.75222338e-15, 9.35837855e+04, -192.0223395]
|
||
|
note: Hf:Gurvich,1996a pt1 p37. Yu,1998. Duncan,1985. [g 5/00]
|
||
|
- name: B2O
|
||
|
composition: {B: 2, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.69954676e+04, 1018.000465, -2.636481947, 0.02746009279, -3.63243272e-05,
|
||
|
2.406890217e-08, -6.38412972e-12, 1.703874394e+04, 38.5534611]
|
||
|
- [-1.62872322e+05, -387.628981, 7.78772352, -1.146822108e-04, 2.528097612e-08,
|
||
|
-2.893783941e-12, 1.339210475e-16, 2.263035354e+04, -19.08513011]
|
||
|
note: Gurvich,1996a pt1 p19 pt2 p14. [g 9/98]
|
||
|
- name: B2O2
|
||
|
composition: {B: 2, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8.17439169e+04, -1732.702797, 16.05560926, -0.02160057288, 3.56685457e-05,
|
||
|
-2.660198794e-08, 7.53183324e-12, -4.8996329e+04, -61.7270239]
|
||
|
- [4.60578966e+05, -2990.079203, 12.56764079, -7.85097495e-04, 1.672537624e-07,
|
||
|
-1.86769478e-11, 8.48619067e-16, -4.01574815e+04, -48.7441371]
|
||
|
note: Gurvich,1996a pt1 p19 pt2 p15. [tpis96]
|
||
|
- name: B2O3
|
||
|
composition: {B: 2, O: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7.37961191e+04, -1263.620592, 10.72681512, 3.84138372e-04, 5.97605838e-06,
|
||
|
-6.55289135e-09, 2.123951064e-12, -9.62818314e+04, -30.88078011]
|
||
|
- [3.9050353e+05, -3691.34821, 15.55502598, -9.70764551e-04, 2.068887872e-07,
|
||
|
-2.310858356e-11, 1.050136734e-15, -8.26305441e+04, -63.9086344]
|
||
|
note: Gurvich,1996a pt1 p25 pt2 p18. [tpis96]
|
||
|
- name: B2(OH)4
|
||
|
composition: {B: 2, O: 4, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.728717249e+04, 849.591348, -8.71595957, 0.0936236261, -1.278784165e-04,
|
||
|
8.81367116e-08, -2.400605571e-11, -1.564337133e+05, 71.2016931]
|
||
|
- [2.983925656e+06, -1.207469577e+04, 31.6261057, -5.16368244e-04, -4.23209397e-08,
|
||
|
1.67197728e-11, -1.156366726e-15, -8.28097697e+04, -165.3010498]
|
||
|
note: Gurvich,1996a pt1 p52 pt2 p33. [g 9/98]
|
||
|
- name: B3H7,C2v
|
||
|
composition: {B: 3, H: 7}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.086009469e+05, -792.15368, -0.957736804, 0.0565611929, -6.4050345e-05,
|
||
|
4.28132296e-08, -1.227580455e-11, 2.430638819e+04, 21.02582666]
|
||
|
- [3.59859214e+06, -1.863701968e+04, 39.9399883, -4.27541016e-03, 8.70535882e-07,
|
||
|
-9.38510502e-11, 4.14786531e-15, 1.272154092e+05, -237.9769856]
|
||
|
note: C2v symmetry. Stanton,1989b. [g 8/00]
|
||
|
- name: B3H7,Cs
|
||
|
composition: {B: 3, H: 7}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [5.29816933e+04, 407.174537, -9.63573053, 0.07944312, -9.30645682e-05,
|
||
|
6.10514735e-08, -1.685927691e-11, 1.707069083e+04, 68.7396656]
|
||
|
- [3.28157645e+06, -1.811096595e+04, 39.6383246, -4.17842411e-03, 8.52682906e-07,
|
||
|
-9.20960024e-11, 4.07649677e-15, 1.213622564e+05, -235.7090217]
|
||
|
note: Cs symmetry. Stanton,1989b. [g 8/00]
|
||
|
- name: B3H9
|
||
|
composition: {B: 3, H: 9}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8.4832149e+04, -520.616304, -0.466570121, 0.0534698386, -4.15579682e-05,
|
||
|
1.944135439e-08, -4.54122735e-12, 1.8051011e+04, 21.10804198]
|
||
|
- [3.8639995e+06, -2.229433407e+04, 48.7504615, -5.41844926e-03, 1.125767651e-06,
|
||
|
-1.233226406e-10, 5.52034818e-15, 1.422187123e+05, -295.8240102]
|
||
|
note: Hf:McKee,1990. Stanton,1989a. [g 7/00]
|
||
|
- name: B3N3H6
|
||
|
composition: {B: 3, N: 3, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.552621082e+05, 4010.21127, -33.824913, 0.1624575582, -2.065528647e-04,
|
||
|
1.368862991e-07, -3.6734709e-11, -8.0512534e+04, 199.5000751]
|
||
|
- [3.73924517e+06, -1.941238951e+04, 44.4507003, -3.21030805e-03, 5.71746542e-07,
|
||
|
-5.48669214e-11, 2.191943197e-15, 4.75842616e+04, -264.1156625]
|
||
|
note: Borazole. Gurvich,1996a pt1 p107 pt2 p85. [tpis96]
|
||
|
- name: B3O3CL3
|
||
|
composition: {B: 3, O: 3, Cl: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.2844528e+04, 1005.623966, -4.55651963, 0.0811796714, -1.038385803e-04,
|
||
|
6.62142233e-08, -1.695748504e-11, -2.040907277e+05, 54.66113803]
|
||
|
- [-7.41405981e+05, -2527.447455, 26.87263667, -7.46338936e-04, 1.64633411e-07,
|
||
|
-1.886231553e-11, 8.73792631e-16, -1.923509858e+05, -118.5636255]
|
||
|
note: Gurvich,1996a pt1 p80 pt2 p57. [tpis96]
|
||
|
- name: B3O3FCL2
|
||
|
composition: {B: 3, O: 3, F: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.71912007e+04, 867.374589, -4.09577846, 0.0781556397, -9.76703517e-05,
|
||
|
6.09761009e-08, -1.532880319e-11, -2.331383552e+05, 51.98088158]
|
||
|
- [-7.16236083e+05, -2851.210308, 27.10953133, -8.40091964e-04, 1.852318684e-07,
|
||
|
-2.121694694e-11, 9.82729156e-16, -2.202729252e+05, -121.0679365]
|
||
|
note: Gurvich,1996a pt1 p89 pt2 p68. [tpis96]
|
||
|
- name: B3O3F2CL
|
||
|
composition: {B: 3, O: 3, F: 2, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.27701554e+04, 1104.904696, -5.85418105, 0.079539431, -9.59266077e-05,
|
||
|
5.79985631e-08, -1.416698348e-11, -2.640400115e+05, 60.71247222]
|
||
|
- [-6.81078749e+05, -3370.00902, 27.48953579, -9.90544256e-04, 2.18290844e-07,
|
||
|
-2.49957348e-11, 1.157532106e-15, -2.472114785e+05, -126.1501548]
|
||
|
note: Gurvich,1996a pt1 p89 pt2 p67. [tpis96]
|
||
|
- name: B3O3F3
|
||
|
composition: {B: 3, O: 3, F: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.25154978e+04, 1400.996228, -7.9067162, 0.0821716185, -9.63315266e-05,
|
||
|
5.66819426e-08, -1.349024305e-11, -2.953461728e+05, 70.0153683]
|
||
|
- [-6.62982291e+05, -3784.94687, 27.79526578, -1.112096232e-03, 2.450806704e-07,
|
||
|
-2.80648498e-11, 1.299750466e-15, -2.748865475e+05, -131.5605015]
|
||
|
note: Gurvich,1996a pt1 p67 pt2 p44. [tpis96]
|
||
|
- name: B4H4
|
||
|
composition: {B: 4, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.171791579e+05, -2598.282557, 9.84544061, 0.0302630914, -4.12833416e-05,
|
||
|
3.089368344e-08, -9.35338426e-12, 5.07914348e+04, -37.7075721]
|
||
|
- [1.937200886e+06, -1.078185932e+04, 28.79625241, -2.401547707e-03,
|
||
|
4.83775678e-07, -5.17049023e-11, 2.269138182e-15, 9.83659539e+04,
|
||
|
-156.1814117]
|
||
|
note: Yu,1998. Mach,1994. [g 8/00]
|
||
|
- name: B4H10
|
||
|
composition: {B: 4, H: 10}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.29660482e+04, 2440.532922, -26.85332563, 0.1406499347, -1.586710574e-04,
|
||
|
9.87459413e-08, -2.601426018e-11, -3091.924018, 158.9905532]
|
||
|
- [4.03047413e+06, -2.560629762e+04, 56.8723366, -6.17856786e-03, 1.280621032e-06,
|
||
|
-1.400254585e-10, 6.25886656e-15, 1.506009087e+05, -352.07142]
|
||
|
note: Wagman,1982 p123. McKee,1990. Dain,1981. [g 5/00]
|
||
|
- name: B4H12
|
||
|
composition: {B: 4, H: 12}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7.1521703e+04, -159.0351575, -4.71977166, 0.088112289, -8.60494688e-05,
|
||
|
5.12353551e-08, -1.37986525e-11, 2.194186547e+04, 41.878974]
|
||
|
- [6.1583608e+06, -3.20208673e+04, 66.604436, -7.40636928e-03, 1.512993908e-06,
|
||
|
-1.635619071e-10, 7.24538514e-15, 2.054586275e+05, -414.210686]
|
||
|
note: Shen,1993. Yu,1998. [g 5/00]
|
||
|
- name: B5H9
|
||
|
composition: {B: 5, H: 9}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8.99847372e+04, 104.2533357, -11.95549834, 0.1007310686, -9.86668021e-05,
|
||
|
5.29553518e-08, -1.232119583e-11, 8374.34178, 76.6309048]
|
||
|
- [3.16901762e+06, -2.282503203e+04, 55.1200898, -5.56341142e-03, 1.157837073e-06,
|
||
|
-1.270332301e-10, 5.69426203e-15, 1.334452571e+05, -337.106046]
|
||
|
note: Hf:Chase,1998 p303 3/65.McKee,1990.Beaudet,1988.Yu,1998. [g 6/00]
|
||
|
- name: Br
|
||
|
composition: {Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [-3700.29391, 61.4521542, 2.092120721, 1.37681887e-03, -2.445566658e-06,
|
||
|
2.050975161e-09, -5.144249091e-13, 1.242508647e+04, 8.9961662]
|
||
|
- [-4.7897174e+06, 1.692051999e+04, -20.24085357, 0.01395620355, -3.65623056e-06,
|
||
|
4.489781e-10, -2.122507526e-14, -9.20705496e+04, 166.1695929]
|
||
|
- [-1.240248003e+08, 7.03403473e+04, -10.23087313, 1.373755814e-03,
|
||
|
-7.47647348e-08, 2.160883187e-12, -2.659054603e-17, -5.56310107e+05,
|
||
|
122.6657143]
|
||
|
note: Hf:Cox,1989. Moore,1971. Moore,1970a. Gordon,1999. [g 3/97]
|
||
|
- name: BrCL
|
||
|
composition: {Br: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.653291583e+04, -357.876928, 5.70062216, -2.201257188e-03, 2.415146969e-06,
|
||
|
-1.371032976e-09, 3.22780342e-13, 2252.619279, -4.155659669]
|
||
|
- [-1.284863067e+05, -1138.379626, 7.9640408, -3.43805667e-03, 1.524999514e-06,
|
||
|
-2.761469114e-10, 1.694450407e-14, 5938.26426, -19.25044389]
|
||
|
note: Gurvich,1989 pt1 p213 pt2 p112. [tpis89]
|
||
|
- name: BrF
|
||
|
composition: {Br: 1, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.83614319e+04, -518.461197, 5.45832705, -5.6568431e-04, -4.12131197e-07,
|
||
|
7.85991348e-10, -3.03616152e-13, -5595.53991, -4.9011295]
|
||
|
- [3.77138847e+06, -1.26749343e+04, 20.8055593, -0.0102635936, 3.30820359e-06,
|
||
|
-4.90319225e-10, 2.64827508e-14, 7.06260972e+04, -113.02536]
|
||
|
note: Gurvich,1989 pt1 p208 pt2 p109. [tpis89]
|
||
|
- name: BrF3
|
||
|
composition: {Br: 1, F: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.116455127e+05, -1959.42433, 15.26220126, -7.9993623e-03, 6.98203026e-06,
|
||
|
-3.24275796e-09, 6.16475146e-13, -2.345341551e+04, -55.226336]
|
||
|
- [-1.88653224e+05, -82.4523297, 10.06180694, -2.477319092e-05, 5.47857686e-09,
|
||
|
-6.28265526e-13, 2.910628214e-17, -3.38680037e+04, -22.98937369]
|
||
|
note: Gurvich,1989 pt1 p211 pt2 p110. [tpis89]
|
||
|
- name: BrF5
|
||
|
composition: {Br: 1, F: 5}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.211366805e+05, -4024.80922, 27.34900212, -0.01832254979, 1.721754649e-05,
|
||
|
-8.75350863e-09, 1.860196959e-12, -3.53744767e+04, -124.4296466]
|
||
|
- [-3.75764764e+05, -157.5896472, 16.11869838, -4.7764978e-05, 1.059755365e-08,
|
||
|
-1.218527723e-12, 5.65753545e-17, -5.6672668e+04, -55.4083931]
|
||
|
note: Gurvich,1989 pt1 p212 pt2 p111. [tpis89]
|
||
|
- name: BrO
|
||
|
composition: {Br: 1, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.455431116e+04, 122.5152439, -0.3058728672, 0.02117309202, -3.49426119e-05,
|
||
|
2.622639719e-08, -7.50805954e-12, 1.389149932e+04, 25.27867438]
|
||
|
- [-2.392612795e+06, 6932.79313, -2.513183892, 3.44654456e-03, -7.56953684e-07,
|
||
|
6.51429134e-11, -1.715768736e-15, -3.084499064e+04, 53.6104836]
|
||
|
note: Chase,1996a. [j 3/96]
|
||
|
- name: OBrO
|
||
|
composition: {Br: 1, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.47021323e+04, -340.134182, 3.93225162, 0.01215938586, -1.901501702e-05,
|
||
|
1.398631495e-08, -3.99289976e-12, 1.875955788e+04, 6.36123518]
|
||
|
- [-1.62450466e+05, -145.3689372, 7.10582213, -4.14136207e-05, 8.98183326e-09,
|
||
|
-1.013712869e-12, 4.63513314e-17, 1.650075386e+04, -9.11181792]
|
||
|
note: Chase,1996a. [j 3/96]
|
||
|
- name: BrOO
|
||
|
composition: {Br: 1, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.4176199e+04, 495.963716, 3.23988495, 5.94150211e-03, -3.40269677e-06,
|
||
|
-3.44477816e-11, 4.81195795e-13, 8815.22198, 16.07446878]
|
||
|
- [6172.48348, -658.504966, 7.48395533, -1.920530746e-04, 4.22694617e-08,
|
||
|
-4.83739261e-12, 2.23974132e-16, 1.46035347e+04, -9.85038024]
|
||
|
note: Chase,1996a. [j 3/96]
|
||
|
- name: BrO3
|
||
|
composition: {Br: 1, O: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.063901881e+05, -1501.928813, 9.70365743, 8.13300076e-03, -1.531857845e-05,
|
||
|
1.199117619e-08, -3.51274787e-12, 3.23313599e+04, -27.3512543]
|
||
|
- [-2.822851113e+05, -235.8973461, 10.17525279, -6.97845105e-05, 1.535701661e-08,
|
||
|
-1.75445495e-12, 8.10410015e-17, 2.40114014e+04, -25.88197197]
|
||
|
note: Chase,1996a. [j 3/96]
|
||
|
- name: Br2
|
||
|
composition: {Br: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7497.04754, -235.0884557, 5.49193432, -2.227573303e-03, 2.932401703e-06,
|
||
|
-1.954889514e-09, 5.31230789e-13, 3521.47505, -1.96415157]
|
||
|
- [-4.31169857e+06, 1.111268634e+04, -5.55577561, 3.63051659e-03, -2.754164226e-07,
|
||
|
-6.21750676e-11, 7.37534162e-15, -7.03658416e+04, 78.7847802]
|
||
|
note: Gurvich,1989 pt1 p200 pt2 p104. [tpis89]
|
||
|
- name: BrBrO
|
||
|
composition: {Br: 2, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.617498037e+04, -246.4406776, 5.91285845, 4.98035428e-03, -8.09995825e-06,
|
||
|
6.07277626e-09, -1.753715313e-12, 1.974012093e+04, 2.009704963]
|
||
|
- [-8.53710175e+04, -64.8704607, 7.04715935, -1.843088186e-05, 3.99226786e-09,
|
||
|
-4.50068795e-13, 2.055867395e-17, 1.821566655e+04, -3.162186125]
|
||
|
note: Chase,1996a. [j 3/96]
|
||
|
- name: BrOBr
|
||
|
composition: {Br: 2, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [6.40506891e+04, -1062.722566, 9.90786629, -4.47049247e-03, 3.91370107e-06,
|
||
|
-1.805444867e-09, 3.36613255e-13, 1.642921537e+04, -23.50319399]
|
||
|
- [-9.68666025e+04, -39.5739527, 7.02943438, -1.171881908e-05, 2.576958549e-09,
|
||
|
-2.941186078e-13, 1.357198784e-17, 1.076942321e+04, -5.69777938]
|
||
|
note: Chase,1996a. [j 3/96]
|
||
|
- name: C
|
||
|
composition: {C: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [649.503147, -0.964901086, 2.504675479, -1.281448025e-05, 1.980133654e-08,
|
||
|
-1.606144025e-11, 5.314483411e-15, 8.54576311e+04, 4.747924288]
|
||
|
- [-1.289136472e+05, 171.9528572, 2.646044387, -3.35306895e-04, 1.74209274e-07,
|
||
|
-2.902817829e-11, 1.642182385e-15, 8.41059785e+04, 4.130047418]
|
||
|
- [4.43252801e+08, -2.886018412e+05, 77.3710832, -9.71528189e-03, 6.64959533e-07,
|
||
|
-2.230078776e-11, 2.899388702e-16, 2.355273444e+06, -640.512316]
|
||
|
note: Hf:Douglas,1955. Moore,1970b. Gordon,1999. [g 7/97]
|
||
|
- name: CBr
|
||
|
composition: {C: 1, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4324.44688, -159.6366559, 4.85785659, -4.38943916e-04, 4.40886363e-07,
|
||
|
-2.281330618e-10, 5.44561822e-14, 5.84767725e+04, 0.1351169646]
|
||
|
- [1.021862102e+06, -3243.48436, 8.38822656, -2.242155508e-03, 6.98835537e-07,
|
||
|
-9.71913437e-11, 4.71697624e-15, 7.80592406e+04, -25.18386915]
|
||
|
note: Gurvich,1991 pt1 p157 pt2 p137. [tpis91]
|
||
|
- name: CBr2
|
||
|
composition: {C: 1, Br: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7.24819784e+04, -1128.26123, 9.82230338, -3.8727481e-03, 2.904819596e-06,
|
||
|
-1.061380159e-09, 1.297474642e-13, 4.4377716e+04, -23.61121795]
|
||
|
- [-7.44143141e+05, 421.542783, 8.79679774, -2.726562507e-03, 1.336438546e-06,
|
||
|
-2.304854483e-10, 1.337493953e-14, 3.36461814e+04, -15.99565135]
|
||
|
note: Gurvich,1991 pt1 p159 pt2 p138. [tpis91]
|
||
|
- name: CBr3
|
||
|
composition: {C: 1, Br: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8.56351626e+04, -1275.764123, 11.17190031, 2.341705749e-03, -6.54067141e-06,
|
||
|
5.73671714e-09, -1.777823046e-12, 3.24321589e+04, -27.66468801]
|
||
|
- [-1.926498949e+05, -132.4072178, 10.09808665, -3.89504082e-05, 8.55044501e-09,
|
||
|
-9.74749368e-13, 4.49424559e-17, 2.541576129e+04, -18.66868947]
|
||
|
note: Gurvich,1991 pt1 p160 pt2 p139. [tpis91]
|
||
|
- name: CBr4
|
||
|
composition: {C: 1, Br: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.023083739e+05, -1735.600709, 16.51317914, -3.147664747e-03, 2.924135486e-07,
|
||
|
1.360605681e-09, -6.43175865e-13, 1.500502543e+04, -55.3647676]
|
||
|
- [-2.059785072e+05, -104.8517002, 13.0777255, -3.086857556e-05, 6.77530981e-09,
|
||
|
-7.72183754e-13, 3.55921824e-17, 5615.89394, -32.8378763]
|
||
|
note: Kudchadker,1975. [g 8/99]
|
||
|
- name: CCL
|
||
|
composition: {C: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.707070049e+04, -14.63803497, 2.334108251, 7.20209913e-03, -1.034120045e-05,
|
||
|
7.2281067e-09, -1.985123755e-12, 5.1233503e+04, 12.00820386]
|
||
|
- [5.90050763e+05, -2075.31146, 6.88001723, -1.294796228e-03, 3.88313798e-07,
|
||
|
-5.00698163e-11, 2.218229619e-15, 6.35892205e+04, -16.10664472]
|
||
|
note: Hf:Kumaran,1997. Gurvich,1991 pt1 p106 pt2 p81. [g 8/99]
|
||
|
- name: CCLBr3
|
||
|
composition: {C: 1, Cl: 1, Br: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.021596752e+05, -1746.281176, 15.98215634, -1.350975234e-03, -2.330039129e-06,
|
||
|
3.20185627e-09, -1.150412393e-12, 1.341967771e+04, -52.85079043]
|
||
|
- [-2.282709343e+05, -127.7037936, 13.09470658, -3.76332671e-05, 8.2647156e-09,
|
||
|
-9.42423756e-13, 4.34594076e-17, 3930.46331, -33.15414033]
|
||
|
note: Gurvich,1991 pt1 p171 pt2 p152. [tpis91]
|
||
|
- name: CCL2
|
||
|
composition: {C: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7.50962315e+04, -1034.728559, 8.06170454, 1.487134213e-03, -4.56481711e-06,
|
||
|
3.95488581e-09, -1.166197091e-12, 3.052409293e+04, -17.39691692]
|
||
|
- [-6.43745517e+06, 1.958413353e+04, -16.04038625, 0.01238833906, -3.013367274e-06,
|
||
|
3.47346892e-10, -1.553272793e-14, -9.96124216e+04, 155.6949315]
|
||
|
note: Hf:Kumaran,1997. Jacox,1994. Shin,1990. [g 8/99]
|
||
|
- name: CCL2Br2
|
||
|
composition: {C: 1, Cl: 2, Br: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.018495619e+05, -1740.854039, 15.21338304, 1.12825651e-03, -5.87540549e-06,
|
||
|
5.65988697e-09, -1.821576512e-12, 6918.57219, -50.15385819]
|
||
|
- [-2.553347012e+05, -159.8005477, 13.1186093, -4.71744387e-05, 1.036912808e-08,
|
||
|
-1.183321687e-12, 5.46061269e-17, -2588.63698, -34.61705319]
|
||
|
note: Gurvich,1991 pt1 p170 pt2 p151. [tpis91]
|
||
|
- name: CCL3
|
||
|
composition: {C: 1, Cl: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.41447165e+04, -554.796973, 6.84554439, 0.01242006495, -2.036896881e-05,
|
||
|
1.554979993e-08, -4.56894011e-12, 9388.56882, -7.143598465]
|
||
|
- [-5.42757254e+05, 680.902062, 9.04772362, 1.324277766e-04, 6.30126304e-08,
|
||
|
-2.6566392e-11, 2.105668053e-15, 386.621615, -15.28745849]
|
||
|
note: Hf:Hudgens,1991. TRC(12/93) tuv7270. [n12/93]
|
||
|
- name: CCL3Br
|
||
|
composition: {C: 1, Cl: 3, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.049668463e+05, -1793.828482, 14.89250892, 2.39712831e-03, -7.78961547e-06,
|
||
|
7.01661711e-09, -2.196069746e-12, 910.134931, -50.58348139]
|
||
|
- [-2.772324186e+05, -184.0310333, 13.13673812, -5.44391001e-05, 1.197658923e-08,
|
||
|
-1.367818632e-12, 6.31616479e-17, -8895.85769, -36.69528209]
|
||
|
note: Gurvich,1991 pt1 p169 pt2 p150. [tpis91]
|
||
|
- name: CCL4
|
||
|
composition: {C: 1, Cl: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.093385626e+05, -1861.731846, 14.49632467, 3.94948516e-03, -1.010805379e-05,
|
||
|
8.64551417e-09, -2.642368852e-12, -4948.00623, -51.8028475]
|
||
|
- [-3.043078255e+05, -216.8170491, 13.16132386, -6.43112489e-05, 1.416482497e-08,
|
||
|
-1.61934332e-12, 7.48397435e-17, -1.51232007e+04, -39.968443]
|
||
|
note: Gurvich,1991 pt1 p111 pt2 p84. [tpis91]
|
||
|
- name: CF
|
||
|
composition: {C: 1, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.58278668e+04, 797.263589, -1.364936319, 0.01312359375, -1.457012892e-05,
|
||
|
8.25327668e-09, -1.896351845e-12, 2.43825962e+04, 32.4806528]
|
||
|
- [-1.3298071e+05, -121.4340891, 4.45241362, 1.293786948e-04, -3.67055059e-08,
|
||
|
6.59021239e-12, -3.73126161e-16, 2.815934108e+04, -0.664046873]
|
||
|
note: Hf:TRC(6/88) w6950. Gurvich,1991 pt1 p74 pt2 p55. [tpis91]
|
||
|
- name: CFBr3
|
||
|
composition: {C: 1, F: 1, Br: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [5.14924428e+04, -936.479664, 10.44260886, 0.01205370047, -1.876290291e-05,
|
||
|
1.344488618e-08, -3.73054576e-12, -1.243246293e+04, -23.63948551]
|
||
|
- [-2.729158956e+05, -332.816465, 13.24822519, -9.92707754e-05, 2.193640054e-08,
|
||
|
-2.515424945e-12, 1.165680878e-16, -1.730185479e+04, -36.2681843]
|
||
|
note: Gurvich,1991 pt1 p166 pt2 p146. [tpis91]
|
||
|
- name: CFCL
|
||
|
composition: {C: 1, F: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.541997945e+04, -82.7403981, 2.501701822, 0.01390738086, -1.8957347e-05,
|
||
|
1.261934581e-08, -3.33345382e-12, 2411.755114, 13.31517094]
|
||
|
- [-2.681630077e+05, -2.328091539, 6.83463383, 1.565270633e-04, -5.96775516e-08,
|
||
|
9.82092446e-12, -5.05889721e-16, 301.7669604, -9.005085129]
|
||
|
note: Hf:Gurvich,1991 pt1 p135 pt2 p107. Jacox,1994. [g 9/99]
|
||
|
- name: CFCLBr2
|
||
|
composition: {C: 1, F: 1, Cl: 1, Br: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [5.89879974e+04, -1050.714861, 10.39349401, 0.01273690622, -1.999097478e-05,
|
||
|
1.43820423e-08, -4.00013035e-12, -1.837799602e+04, -24.17479131]
|
||
|
- [-2.960811596e+05, -353.12762, 13.26346169, -1.053860298e-04, 2.32908508e-08,
|
||
|
-2.670979639e-12, 1.237844667e-16, -2.387594306e+04, -36.84977271]
|
||
|
note: Gurvich,1991 pt1 p175 pt2 p158. [tpis91]
|
||
|
- name: CFCL2
|
||
|
composition: {C: 1, F: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.611398792e+04, -335.35659, 4.09467308, 0.01960244711, -2.762775193e-05,
|
||
|
1.880124302e-08, -5.0474103e-12, -1.251298871e+04, 6.870882561]
|
||
|
- [-2.653118323e+05, -446.972417, 10.33334881, -1.333673368e-04, 2.948755634e-08,
|
||
|
-3.3833062e-12, 1.568746348e-16, -1.393160489e+04, -25.56817972]
|
||
|
note: Gurvich,1991 pt1 p138 pt2 p110. [tpis91]
|
||
|
- name: CFCL2Br
|
||
|
composition: {C: 1, F: 1, Cl: 2, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [6.52995922e+04, -1135.235485, 10.09526872, 0.01401380147, -2.191705096e-05,
|
||
|
1.573404132e-08, -4.36934034e-12, -2.504488145e+04, -24.51093103]
|
||
|
- [-3.21545505e+05, -388.412962, 13.28990796, -1.160048581e-04, 2.564498787e-08,
|
||
|
-2.941639768e-12, 1.363542881e-16, -3.097421144e+04, -38.71356695]
|
||
|
note: Gurvich,1991 pt1 p175 pt2 p157. [tpis91]
|
||
|
- name: CFCL3
|
||
|
composition: {C: 1, F: 1, Cl: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7.400174e+04, -1252.282466, 10.01327229, 0.01475107601, -2.315635251e-05,
|
||
|
1.664207025e-08, -4.62292996e-12, -3.020508601e+04, -27.08387087]
|
||
|
- [-3.45046478e+05, -417.782145, 13.31196736, -1.248759531e-04, 2.761391353e-08,
|
||
|
-3.16820764e-12, 1.468834601e-16, -3.67406719e+04, -41.56886057]
|
||
|
note: Hf:TRC(6/89) w7350. Gurvich,1991 pt1 p140 pt2 p112. [g 7/99]
|
||
|
- name: CF2
|
||
|
composition: {C: 1, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.79702627e+04, 873.180003, -3.46019157, 0.02746253741, -3.4746219e-05,
|
||
|
2.204470693e-08, -5.62175085e-12, -2.746797157e+04, 44.5677807]
|
||
|
- [-1.086428547e+05, -585.498914, 7.01864895, 3.92918615e-04, -2.603822675e-07,
|
||
|
6.14219639e-11, -4.17283326e-15, -2.152945157e+04, -13.56143285]
|
||
|
note: Hf:TRC(6/88) w6950. Jacox,1998. [g 9/99]
|
||
|
- name: CF2Br2
|
||
|
composition: {C: 1, F: 2, Br: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.261404028e+04, -281.5725114, 5.09803213, 0.02502548939, -3.43885319e-05,
|
||
|
2.297615553e-08, -6.08016143e-12, -4.64276375e+04, 3.094167118]
|
||
|
- [-3.3276693e+05, -618.435249, 13.46170049, -1.849172548e-04, 4.09259134e-08,
|
||
|
-4.69981043e-12, 2.180811799e-16, -4.71518661e+04, -41.0536924]
|
||
|
note: Gurvich,1991 pt1 p166 pt2 p145. [tpis91]
|
||
|
- name: CF2CL
|
||
|
composition: {C: 1, F: 2, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8914.55835, -17.68816959, 1.607015025, 0.02473626554, -3.27073894e-05,
|
||
|
2.12635183e-08, -5.50983111e-12, -3.42730625e+04, 19.2968069]
|
||
|
- [-2.802346654e+05, -686.031485, 10.51143635, -2.046954963e-04, 4.52889718e-08,
|
||
|
-5.20022903e-12, 2.41297145e-16, -3.30817948e+04, -28.74899785]
|
||
|
note: Gurvich,1991 pt1 p136 pt2 p108. [tpis91]
|
||
|
- name: CF2CLBr
|
||
|
composition: {C: 1, F: 2, Cl: 1, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.696699365e+04, -467.883227, 5.24480942, 0.02530121349, -3.50844352e-05,
|
||
|
2.354353958e-08, -6.24616113e-12, -5.19838273e+04, 0.8532887803]
|
||
|
- [-3.59282884e+05, -653.928359, 13.48831524, -1.956099469e-04, 4.32977597e-08,
|
||
|
-4.97264437e-12, 2.30757505e-16, -5.36514117e+04, -42.24913908]
|
||
|
note: Gurvich,1991 pt1 p173 pt2 p156. [tpis91]
|
||
|
- name: CF2CL2
|
||
|
composition: {C: 1, F: 2, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.84125875e+04, -613.949982, 5.26966719, 0.02574105783, -3.58737648e-05,
|
||
|
2.41160013e-08, -6.4022369e-12, -5.78454133e+04, -1.957454856]
|
||
|
- [-3.82744855e+05, -693.37748, 13.51791274, -2.075114435e-04, 4.59402161e-08,
|
||
|
-5.2768746e-12, 2.449037044e-16, -6.02152777e+04, -44.79580046]
|
||
|
note: Hf:TRC(6/89) w7350.Gurvich,1991 pt1 p139 pt2 p111. [g 7/99]
|
||
|
- name: CF3
|
||
|
composition: {C: 1, F: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.978307106e+04, 715.367883, -3.49818538, 0.0359545799, -4.50797443e-05,
|
||
|
2.82180845e-08, -7.09804702e-12, -6.05999703e+04, 45.0259264]
|
||
|
- [-2.997305557e+05, -1046.989457, 10.77923191, -3.116087076e-04, 6.89135143e-08,
|
||
|
-7.91122564e-12, 3.67059302e-16, -5.4253044e+04, -34.1703879]
|
||
|
note: Hf:TRC(6/88) w6950. Jacox,1998. [g 8/99]
|
||
|
- name: CF3Br
|
||
|
composition: {C: 1, F: 3, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5439.48901, 124.361519, 0.923194195, 0.0348104438, -4.54964549e-05,
|
||
|
2.932836552e-08, -7.54800036e-12, -8.02339676e+04, 22.32999096]
|
||
|
- [-3.83408851e+05, -971.90933, 13.72477396, -2.901710612e-04, 6.4218922e-08,
|
||
|
-7.37568877e-12, 3.42315425e-16, -7.76530631e+04, -47.1736721]
|
||
|
note: Gurvich,1991 pt1 p165 pt2 p144. [tpis91]
|
||
|
- name: CF3CL
|
||
|
composition: {C: 1, F: 3, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.499409978e+04, -136.5768572, 1.45291237, 0.0340476507, -4.47377764e-05,
|
||
|
2.888115112e-08, -7.43417133e-12, -8.54716664e+04, 17.27327095]
|
||
|
- [-4.06604212e+05, -1022.626507, 13.76252628, -3.052722979e-04, 6.75596604e-08,
|
||
|
-7.75931525e-12, 3.60119229e-16, -8.41055937e+04, -49.13411939]
|
||
|
note: Hf:TRC(6/89) w7350. Gurvich,1991 pt1 p137 pt2 p109. [g 7/99]
|
||
|
- name: CF4
|
||
|
composition: {C: 1, F: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [9817.4585, 116.3343483, -1.288338636, 0.0395956691, -4.99624421e-05,
|
||
|
3.125339346e-08, -7.84170032e-12, -1.138502297e+05, 29.38656548]
|
||
|
- [-4.16445678e+05, -1414.797167, 14.05124837, -4.19909386e-04, 9.27892161e-08,
|
||
|
-1.06457583e-11, 4.93709968e-16, -1.094691149e+05, -54.87105]
|
||
|
note: Hf:TRC(12/94) w6520. Gurvich,1991 pt1 p79 pt2 p58. [g 7/99]
|
||
|
- name: CH
|
||
|
composition: {C: 1, H: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [2.220590133e+04, -340.541153, 5.53145229, -5.79496426e-03, 7.96955488e-06,
|
||
|
-4.46591159e-09, 9.59633832e-13, 7.24078327e+04, -9.10767305]
|
||
|
- [2.06076344e+06, -5396.20666, 7.85629385, -7.96590745e-04, 1.764308305e-07,
|
||
|
-1.976386267e-11, 5.03042951e-16, 1.062236592e+05, -31.54757439]
|
||
|
- [-8.06836869e+08, 4.57545054e+05, -98.4397508, 0.01235244098, -8.48560857e-07,
|
||
|
3.040410624e-11, -4.40031517e-16, -3.59585159e+06, 895.347744]
|
||
|
note: Gurvich,1979 pt1 p37 pt2 p39. [tpis79]
|
||
|
- name: CHBr3
|
||
|
composition: {C: 1, H: 1, Br: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4.34657686e+04, -499.963442, 5.62022211, 0.02079346321, -2.921336328e-05,
|
||
|
2.066942448e-08, -5.78122091e-12, 2627.830062, 1.247904015]
|
||
|
- [6.27423495e+05, -3378.7111, 14.87852612, -5.93274527e-04, 1.082421577e-07,
|
||
|
-1.061012665e-11, 4.31915245e-16, 1.877234659e+04, -53.1190965]
|
||
|
note: Kudchadker,1975. [g 8/99]
|
||
|
- name: CHCL
|
||
|
composition: {C: 1, H: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.699912334e+05, 4351.19973, -22.75911813, 0.0755062176, -9.07199797e-05,
|
||
|
5.25697186e-08, -1.189769182e-11, 1.41686268e+04, 152.0980812]
|
||
|
- [-9.5480619e+05, 2174.413794, 4.86764537, 8.32164186e-04, -1.536948638e-07,
|
||
|
1.529236537e-11, -6.59615936e-16, 1.88012181e+04, 2.674761385]
|
||
|
note: Hf:TRC(12/93) w7270.Gurvich,1991. Jacox,1998. [g 9/99]
|
||
|
- name: CHCLBr2
|
||
|
composition: {C: 1, H: 1, Cl: 1, Br: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.81538025e+04, -408.417511, 4.63924402, 0.02325990646, -3.22298886e-05,
|
||
|
2.254671151e-08, -6.25650774e-12, 1483.809044, 6.175235281]
|
||
|
- [6.0428653e+05, -3438.24101, 14.94162631, -6.22842797e-04, 1.153724426e-07,
|
||
|
-1.147291377e-11, 4.73348286e-16, 1.822460958e+04, -54.07258924]
|
||
|
note: Gurvich,1991 pt1 p173 pt2 p155. [tpis91]
|
||
|
- name: CHCL2
|
||
|
composition: {C: 1, H: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [5.63855613e+04, -656.245542, 6.06881802, 9.7441226e-03, -1.275310131e-05,
|
||
|
8.55238672e-09, -2.2315827e-12, 1.330447798e+04, -4.533535456]
|
||
|
- [8.84939371e+05, -3526.96973, 11.86372153, -5.00237612e-04, 6.1338604e-08,
|
||
|
-1.885433405e-12, -1.234221421e-16, 3.071136475e+04, -40.88905858]
|
||
|
note: TRC(12/93) tuvw7270. [n12/93]
|
||
|
- name: CHCL2Br
|
||
|
composition: {C: 1, H: 1, Cl: 2, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.29402265e+04, -327.530117, 3.77323524, 0.02536466143, -3.47266699e-05,
|
||
|
2.404666618e-08, -6.62173093e-12, -5425.56508, 9.433412004]
|
||
|
- [5.92487644e+05, -3509.47561, 14.99349593, -6.43306257e-04, 1.198581809e-07,
|
||
|
-1.198476716e-11, 4.96994807e-16, 1.197251405e+04, -56.02687781]
|
||
|
note: Gurvich,1991 pt1 p172 pt2 p154. [tpis91]
|
||
|
- name: CHCL3
|
||
|
composition: {C: 1, H: 1, Cl: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.39533329e+04, -304.7428785, 2.923672263, 0.02830547858, -3.71242469e-05,
|
||
|
2.551365915e-08, -6.98765955e-12, -1.235063157e+04, 11.15556408]
|
||
|
- [6.13605274e+05, -3715.08717, 15.10777247, 2.362584336e-04, 1.297140438e-07,
|
||
|
-1.267494791e-11, 5.25902231e-16, 6203.31345, -59.92576539]
|
||
|
note: Gurvich,1991 pt1 p127 pt2 p98. [g 7/99]
|
||
|
- name: CHF
|
||
|
composition: {C: 1, H: 1, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.86858583e+04, 1300.218466, -3.94768525, 0.02114995848, -2.239962738e-05,
|
||
|
1.283155181e-08, -2.904778136e-12, 5824.38972, 47.8545377]
|
||
|
- [3.99408542e+06, -7962.7562, 6.75559509, 4.94983657e-03, -2.101763812e-06,
|
||
|
3.34823295e-10, -1.88682505e-14, 6.70613494e+04, -23.81240379]
|
||
|
note: Hf:TRC(6/88) w695. Jacox,1998. [g 8/99]
|
||
|
- name: CHFBr2
|
||
|
composition: {C: 1, H: 1, F: 1, Br: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.82019798e+04, 436.224967, -0.373385417, 0.033886314, -4.37129853e-05,
|
||
|
2.889569295e-08, -7.68391511e-12, -2.465611586e+04, 33.2047879]
|
||
|
- [5.93575163e+05, -3742.65658, 15.17184031, -7.15803903e-04, 1.360636972e-07,
|
||
|
-1.385897355e-11, 5.84420911e-16, -2347.676027, -57.6578343]
|
||
|
note: Gurvich,1991 pt1 p168 pt2 p149. [tpis91]
|
||
|
- name: CHFCL
|
||
|
composition: {C: 1, H: 1, F: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.11300851e+04, 1377.872745, -6.48461724, 0.0389097249, -4.80073522e-05,
|
||
|
3.073300019e-08, -7.98285341e-12, -1.751793745e+04, 63.73895867]
|
||
|
- [6.62216358e+05, -3809.00798, 12.23880469, -7.46718275e-04, 1.43476785e-07,
|
||
|
-1.475406631e-11, 6.27378068e-16, 1.018987746e+04, -46.58365563]
|
||
|
note: Gurvich,1991 pt1 p147 pt2 p121. [tpis91]
|
||
|
- name: CHFCLBr
|
||
|
composition: {C: 1, H: 1, F: 1, Cl: 1, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.959240614e+04, 490.172327, -1.259408503, 0.0361770847, -4.65424496e-05,
|
||
|
3.065240659e-08, -8.1239036e-12, -3.139900705e+04, 37.10450945]
|
||
|
- [5.80011751e+05, -3823.33785, 15.22809062, -7.37390631e-04, 1.407097155e-07,
|
||
|
-1.438245319e-11, 6.08386715e-16, -8552.2499, -59.03677705]
|
||
|
note: Gurvich,1991 pt1 p176 pt2 p159. [tpis91]
|
||
|
- name: CHFCL2
|
||
|
composition: {C: 1, H: 1, F: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.734959015e+04, 492.49132, -1.854635884, 0.0378278628, -4.86334304e-05,
|
||
|
3.19719763e-08, -8.45905799e-12, -3.78874927e+04, 38.01530544]
|
||
|
- [5.64011302e+05, -3887.0833, 15.27760246, -7.57648742e-04, 1.452498792e-07,
|
||
|
-1.490796515e-11, 6.3289985e-16, -1.484736185e+04, -61.67535516]
|
||
|
note: Hf:TRC(6/89) w7350. Gurvich,1991 pt1 p149 pt2 p124. [g 7/99]
|
||
|
- name: CHF2
|
||
|
composition: {C: 1, H: 1, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.469690117e+05, 2553.397313, -13.0262763, 0.0543812846, -6.71341879e-05,
|
||
|
4.28765173e-08, -1.110824216e-11, -4.17937216e+04, 99.3993025]
|
||
|
- [5.52680655e+05, -3696.00917, 12.08610573, -6.4985881e-04, 1.12084622e-07,
|
||
|
-9.81414701e-12, 3.34919239e-16, -9437.06842, -47.044162]
|
||
|
note: TRC(6/88) tuvw6950. [n 6/88]
|
||
|
- name: CHF2Br
|
||
|
composition: {C: 1, H: 1, F: 2, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.71451016e+04, 1422.544046, -6.68439365, 0.0473838915, -5.83058875e-05,
|
||
|
3.69572047e-08, -9.49548528e-12, -5.87850093e+04, 66.0863909]
|
||
|
- [5.76770684e+05, -4177.71608, 15.50150581, -8.49014729e-04, 1.657177491e-07,
|
||
|
-1.727828054e-11, 7.43562723e-16, -2.966147348e+04, -63.4938014]
|
||
|
note: Gurvich,1991 pt1 p168 pt2 p148. [tpis91]
|
||
|
- name: CHF2CL
|
||
|
composition: {C: 1, H: 1, F: 2, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.24057941e+04, 1365.510973, -7.15322208, 0.0485498797, -5.94878167e-05,
|
||
|
3.75096619e-08, -9.58952442e-12, -6.5659328e+04, 66.5721223]
|
||
|
- [5.62949373e+05, -4298.67305, 15.58191398, -8.78927848e-04, 1.720248689e-07,
|
||
|
-1.797910869e-11, 7.7533917e-16, -3.63406716e+04, -66.1126148]
|
||
|
note: Hf:TRC(6/89) w7350. Gurvich,1991 pt1 p148 pt2 p123. [g 7/99]
|
||
|
- name: CHF3
|
||
|
composition: {C: 1, H: 1, F: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.09513226e+05, 2042.273879, -11.66213079, 0.0578580777, -6.85713506e-05,
|
||
|
4.21211838e-08, -1.053196888e-11, -9.39547005e+04, 89.3592065]
|
||
|
- [5.68523202e+05, -4728.3617, 15.86728516, -7.38234865e-04, 1.970841706e-07,
|
||
|
-2.062115571e-11, 8.97059964e-16, -5.92319637e+04, -71.6127322]
|
||
|
note: Hf:TRC(12/89) w6880. Gurvich,1991 pt1 p97 pt2 p72. [g 8/99]
|
||
|
- name: CHI3
|
||
|
composition: {C: 1, H: 1, I: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [5.25292359e+04, -724.216647, 8.01862334, 0.01470995487, -2.163843469e-05,
|
||
|
1.594571452e-08, -4.60143796e-12, 2.678186915e+04, -8.60505484]
|
||
|
- [6.29420543e+05, -3184.06157, 14.79622178, -5.7495555e-04, 1.062025541e-07,
|
||
|
-1.052804696e-11, 4.32972002e-16, 4.1036098e+04, -49.0135739]
|
||
|
note: Kudchadker,1975. [g 8/99]
|
||
|
- name: CH2
|
||
|
composition: {C: 1, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.21892173e+04, -287.7601815, 4.20358382, 3.45540596e-03, -6.74619334e-06,
|
||
|
7.65457164e-09, -2.870328419e-12, 4.73362471e+04, -2.143628603]
|
||
|
- [2.550418031e+06, -7971.62539, 12.28924487, -1.699122922e-03, 2.991728605e-07,
|
||
|
-2.767007492e-11, 1.05134174e-15, 9.64221689e+04, -60.9473991]
|
||
|
note: 'D0(H2C-H): Ruscic,1999. Bunker,1983. Jacox,1998. [g 4/02]'
|
||
|
- name: CH2Br2
|
||
|
composition: {C: 1, H: 2, Br: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4797.30801, 361.385924, -1.819592338, 0.0347704834, -4.49854618e-05,
|
||
|
3.068623685e-08, -8.43484634e-12, -4481.49706, 38.2712359]
|
||
|
- [1.528284441e+06, -6673.41495, 16.70213316, -1.166351237e-03, 2.122634493e-07,
|
||
|
-2.07547224e-11, 8.4285777e-16, 3.60070664e+04, -74.4806549]
|
||
|
note: Kudchadker, 1975. [g 8/99]
|
||
|
- name: CH2CL
|
||
|
composition: {C: 1, H: 2, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.18858563e+04, 633.316321, -1.164065495, 0.0216058608, -2.545462163e-05,
|
||
|
1.693887757e-08, -4.6600786e-12, 1.02014254e+04, 32.30835289]
|
||
|
- [1.662438334e+06, -6441.12572, 13.59753722, -1.14053681e-03, 2.087760159e-07,
|
||
|
-2.052347186e-11, 8.37577227e-16, 5.21290612e+04, -61.48586271]
|
||
|
note: Hf:TRC(12/93) w7270. Gurvich,1991 pt1 p122. Jacox,1998. [g12/99]
|
||
|
- name: CH2CLBr
|
||
|
composition: {C: 1, H: 2, Cl: 1, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.307948755e+04, 645.586038, -3.57734991, 0.0383368723, -4.86425205e-05,
|
||
|
3.26162233e-08, -8.85287739e-12, -9402.27253, 47.48806758]
|
||
|
- [1.525016309e+06, -6823.33416, 16.82769102, -1.219735119e-03, 2.244964495e-07,
|
||
|
-2.219063248e-11, 9.10470513e-16, 3.32023992e+04, -76.37571062]
|
||
|
note: Gurvich,1991 pt1 p171 pt2 p153. [tpis91]
|
||
|
- name: CH2CL2
|
||
|
composition: {C: 1, H: 2, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.509841179e+04, 868.766738, -5.09466921, 0.0415004999, -5.19977215e-05,
|
||
|
3.44594426e-08, -9.27029252e-12, -1.63897884e+04, 53.9689032]
|
||
|
- [1.529279337e+06, -6976.95476, 16.94154931, -1.265053995e-03, 2.344766734e-07,
|
||
|
-2.333227421e-11, 9.63283473e-16, 2.806318171e+04, -79.4945351]
|
||
|
note: Gurvich,1991 pt1 p125 pt2 p97. [tpis91]
|
||
|
- name: CH2F
|
||
|
composition: {C: 1, H: 2, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-8.56971253e+04, 1392.226749, -4.38205259, 0.02645916948, -2.848145663e-05,
|
||
|
1.732706028e-08, -4.44206144e-12, -1.169444586e+04, 50.494992]
|
||
|
- [2.535399502e+06, -9358.43902, 17.00366206, -3.062919929e-03, 7.61286908e-07,
|
||
|
-9.66455498e-11, 4.8447681e-15, 5.22839131e+04, -87.0755157]
|
||
|
note: TRC(6/88) tuvw6950. [n 6/88]
|
||
|
- name: CH2FBr
|
||
|
composition: {C: 1, H: 2, F: 1, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-9.25610953e+04, 1811.985865, -9.69834687, 0.0503584867, -6.07027268e-05,
|
||
|
3.8782508e-08, -1.012615992e-11, -3.53750962e+04, 81.4039605]
|
||
|
- [1.539975462e+06, -7231.55136, 17.14566439, -1.350184394e-03, 2.538022824e-07,
|
||
|
-2.558977386e-11, 1.069310946e-15, 1.509604224e+04, -80.6205371]
|
||
|
note: Gurvich,1991 pt1 p167 pt2 p147. [tpis91]
|
||
|
- name: CH2FCL
|
||
|
composition: {C: 1, H: 2, F: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.071340332e+05, 2081.328396, -11.55723697, 0.0544148211, -6.51862274e-05,
|
||
|
4.13315988e-08, -1.071935103e-11, -4.26475621e+04, 90.35923547]
|
||
|
- [1.536120418e+06, -7378.93973, 17.25797178, -1.395645457e-03, 2.639247747e-07,
|
||
|
-2.675653563e-11, 1.123582778e-15, 9813.71046, -83.13642553]
|
||
|
note: Hf:TRC(6/89) w7350. Gurvich,1991 pt1 p147 pt2 p122. [g 7/99]
|
||
|
- name: CH2F2
|
||
|
composition: {C: 1, H: 2, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.8199175e+05, 3174.42789, -17.14256906, 0.0641135383, -7.31359212e-05,
|
||
|
4.42638416e-08, -1.103877216e-11, -7.02705895e+04, 120.7331926]
|
||
|
- [1.546609496e+06, -7876.88333, 17.68770469, -1.581298721e-03, 3.068917255e-07,
|
||
|
-3.18340546e-11, 1.363827177e-15, -9800.13596, -89.0742036]
|
||
|
note: Hf:TRC(12/89) w6880. Gurvich,1991 pt1 p96 pt2 p71. [g 8/99]
|
||
|
- name: CH2I2
|
||
|
composition: {C: 1, H: 2, I: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.738133757e+04, -89.7256804, 1.387869408, 0.02733482611, -3.61940877e-05,
|
||
|
2.53918761e-08, -7.14558516e-12, 1.338767276e+04, 22.41870165]
|
||
|
- [1.512892716e+06, -6442.9124, 16.59026137, -1.13555152e-03, 2.07375025e-07,
|
||
|
-2.033902231e-11, 8.2822837e-16, 5.05821903e+04, -71.2523514]
|
||
|
note: Kudchadker,1975. Kudchadker,1976. [g 8/99]
|
||
|
- name: CH3
|
||
|
composition: {C: 1, H: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.876188806e+04, 509.326866, 0.2002143949, 0.01363605829, -1.433989346e-05,
|
||
|
1.013556725e-08, -3.027331936e-12, 1.408271825e+04, 20.22772791]
|
||
|
- [2.760802663e+06, -9336.53117, 14.87729606, -1.439429774e-03, 2.444477951e-07,
|
||
|
-2.224555778e-11, 8.39506576e-16, 7.48180948e+04, -79.196824]
|
||
|
note: 'D0(H3C-H): Ruscic,1999. Jacox,1998. [g 4/02]'
|
||
|
- name: CH3Br
|
||
|
composition: {C: 1, H: 3, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.11558577e+04, 1524.705928, -8.23044521, 0.0423997321, -4.94697989e-05,
|
||
|
3.19443334e-08, -8.53123708e-12, -1.251753591e+04, 70.4812777]
|
||
|
- [2.524874348e+06, -1.011876098e+04, 18.65902163, -1.79767369e-03,
|
||
|
3.29852011e-07, -3.25091203e-11, 1.330179925e-15, 5.54057639e+04,
|
||
|
-97.7866446]
|
||
|
note: Kudchadker,1975. [g 8/99]
|
||
|
- name: CH3CL
|
||
|
composition: {C: 1, H: 3, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-9.8419711e+04, 1983.700841, -10.84512305, 0.0477798005, -5.51551626e-05,
|
||
|
3.50617614e-08, -9.23610396e-12, -1.994689506e+04, 83.99658331]
|
||
|
- [2.522463305e+06, -1.030115447e+04, 18.82725852, -1.872291294e-03,
|
||
|
3.47337286e-07, -3.45888722e-11, 1.428941079e-15, 5.11141741e+04,
|
||
|
-100.6571389]
|
||
|
note: Gurvich,1991 pt1 p122 pt2 p95. [tpis91]
|
||
|
- name: CH3F
|
||
|
composition: {C: 1, H: 3, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.029821878e+05, 3447.33113, -17.68994275, 0.059452758, -6.46952825e-05,
|
||
|
3.85941804e-08, -9.62654153e-12, -4.57792622e+04, 122.8382176]
|
||
|
- [2.561903188e+06, -1.086052758e+04, 19.2944692, -2.070973131e-03,
|
||
|
3.92912453e-07, -3.99450342e-11, 1.681447081e-15, 3.56350851e+04,
|
||
|
-106.1158456]
|
||
|
note: Hf:TRC(12/89) w6880. Gurvich,1991 pt1 p93 pt2 p69. [g 8/99]
|
||
|
- name: CH3I
|
||
|
composition: {C: 1, H: 3, I: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.51646274e+04, 1086.208429, -5.66317627, 0.0368317171, -4.3213935e-05,
|
||
|
2.833483666e-08, -7.68438369e-12, -4303.83065, 56.8856269]
|
||
|
- [2.511915982e+06, -9960.28999, 18.56907132, -1.768191331e-03, 3.24220626e-07,
|
||
|
-3.19294201e-11, 1.305407821e-15, 6.06692995e+04, -95.9077704]
|
||
|
note: Kudchadker,1975. [g 8/99]
|
||
|
- name: CH2OH
|
||
|
composition: {C: 1, H: 3, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.560076238e+05, 2685.446279, -13.4202242, 0.0575713947, -7.28444999e-05,
|
||
|
4.83664886e-08, -1.293492601e-11, -1.59682041e+04, 99.630337]
|
||
|
- [2.250349506e+06, -8173.18606, 15.99639179, -8.70413372e-04, 6.06918395e-08,
|
||
|
4.40834946e-12, -5.7023095e-16, 4.64531343e+04, -78.3515845]
|
||
|
note: Hydroxymethyl Radical. Johnson,1996. [g11/00]
|
||
|
- name: CH3O
|
||
|
composition: {C: 1, H: 3, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8.65711766e+04, -663.168525, 2.257455672, 0.02266283789, -2.970566403e-05,
|
||
|
2.199341353e-08, -6.58804338e-12, 4174.10213, 8.1747779]
|
||
|
- [2.101188243e+06, -8841.9688, 18.22645731, -1.743485034e-03, 3.34043427e-07,
|
||
|
-3.43067316e-11, 1.473897771e-15, 5.30958206e+04, -94.2250059]
|
||
|
note: Hf:Gurvich,1991 pt1 p67. Jacox,1998 p271. [g 7/00]
|
||
|
- name: CH4
|
||
|
composition: {C: 1, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.766850998e+05, 2786.18102, -12.0257785, 0.0391761929, -3.61905443e-05,
|
||
|
2.026853043e-08, -4.97670549e-12, -2.33131436e+04, 89.0432275]
|
||
|
- [3.73004276e+06, -1.383501485e+04, 20.49107091, -1.961974759e-03,
|
||
|
4.72731304e-07, -3.72881469e-11, 1.623737207e-15, 7.53206691e+04,
|
||
|
-121.9124889]
|
||
|
note: Gurvich,1991 pt1 p44 pt2 p36. [g 8/99]
|
||
|
- name: CH3OH
|
||
|
composition: {C: 1, H: 4, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.416642886e+05, 4032.14719, -20.46415436, 0.0690369807, -7.59893269e-05,
|
||
|
4.59820836e-08, -1.158706744e-11, -4.43326117e+04, 140.014219]
|
||
|
- [3.41157076e+06, -1.345500201e+04, 22.61407623, -2.141029179e-03,
|
||
|
3.73005054e-07, -3.49884639e-11, 1.366073444e-15, 5.63608156e+04,
|
||
|
-127.7814279]
|
||
|
note: Hf:TRC(6/87) w5030. Chen,1977. [g 7/00]
|
||
|
- name: CH3OOH
|
||
|
composition: {C: 1, H: 4, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.497974156e+05, 2656.222273, -13.77060625, 0.0658867383, -7.75180165e-05,
|
||
|
4.9688007e-08, -1.31436764e-11, -3.058414201e+04, 103.169685]
|
||
|
- [3.06074061e+06, -1.282959627e+04, 25.41021168, -2.394481095e-03,
|
||
|
4.44342991e-07, -4.4166595e-11, 1.819673372e-15, 5.83749236e+04, -138.7713096]
|
||
|
note: Methyl Hydroperoxide, CH3-O-O-H. Dorofeeva,2001. [srd 01]
|
||
|
- name: CI
|
||
|
composition: {C: 1, I: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.043011064e+05, -1715.427168, 12.88874952, -0.01828504834, 2.135468356e-05,
|
||
|
-1.286980869e-08, 3.16704766e-12, 7.5507847e+04, -44.9681132]
|
||
|
- [-2.408229894e+05, 344.738704, 4.9769687, -8.44481539e-04, 5.06123972e-07,
|
||
|
-1.047700525e-10, 6.74084314e-15, 6.45134202e+04, 1.090913159]
|
||
|
note: Gurvich,1991 pt1 p176 pt2 p160. [tpis91]
|
||
|
- name: CI2
|
||
|
composition: {C: 1, I: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [6.02828981e+04, -1043.205435, 10.17465942, -5.53567171e-03, 5.63031901e-06,
|
||
|
-3.108249657e-09, 7.20246956e-13, 5.96489655e+04, -23.10319208]
|
||
|
- [-7.02865553e+05, 308.2750393, 9.04642705, -2.946736644e-03, 1.424347233e-06,
|
||
|
-2.45318341e-10, 1.425270291e-14, 5.02113421e+04, -15.60349377]
|
||
|
note: Gurvich,1991 pt1 p178 pt2 p161. [tpis91]
|
||
|
- name: CI3
|
||
|
composition: {C: 1, I: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8.59678425e+04, -1347.703793, 12.72103659, -2.442876357e-03, 2.511609978e-07,
|
||
|
1.024658583e-09, -4.87269296e-13, 5.31071651e+04, -32.384929]
|
||
|
- [-1.536511918e+05, -83.5704437, 10.06203125, -2.466447336e-05, 5.41905475e-09,
|
||
|
-6.181417e-13, 2.851262022e-17, 4.58258953e+04, -14.94825345]
|
||
|
note: Gurvich,1991 pt1 p178 pt2 p162. [g 9/99]
|
||
|
- name: CI4
|
||
|
composition: {C: 1, I: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [8.91904387e+04, -1651.906475, 17.96124325, -8.51811425e-03, 8.50868225e-06,
|
||
|
-4.59909773e-09, 1.039492403e-12, 3.68939215e+04, -58.0595312]
|
||
|
- [-1.44676277e+05, -52.8036517, 13.03985589, -1.606214814e-05, 3.56755047e-09,
|
||
|
-4.10536698e-13, 1.907272766e-17, 2.817746618e+04, -28.10414436]
|
||
|
note: Kudchadker,1975. Kudchadker,1976. [g 8/99]
|
||
|
- name: CN
|
||
|
composition: {C: 1, N: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [3949.14857, -139.1590572, 4.93083532, -6.30467051e-03, 1.256836472e-05,
|
||
|
-9.8783005e-09, 2.843137221e-12, 5.22845538e+04, -2.763115585]
|
||
|
- [-2.22800627e+06, 5040.73339, -0.2121897722, 1.354901134e-03, 1.325929798e-07,
|
||
|
-6.93700637e-11, 5.49495227e-15, 1.784496132e+04, 32.82563919]
|
||
|
- [-1.794798118e+08, 1.054346069e+05, -17.2962417, 2.19489553e-03, -8.50893803e-08,
|
||
|
9.31869299e-13, 6.35813993e-18, -7.96259412e+05, 191.3139639]
|
||
|
note: 'Hf: Huang,1992. Gurvich,1979 pt1 p212 pt2 p210. [g 8/99]'
|
||
|
- name: CNN
|
||
|
composition: {C: 1, N: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.35769236e+04, 965.243866, -1.704121157, 0.02037239025, -2.183423906e-05,
|
||
|
1.176082777e-08, -2.551355221e-12, 7.02172983e+04, 35.2815091]
|
||
|
- [-1.817148765e+05, -672.986349, 7.85794834, -6.13688072e-05, -1.088178985e-08,
|
||
|
4.45665581e-12, -2.836496278e-16, 7.72348898e+04, -19.66012324]
|
||
|
note: Gurvich,1991 pt1 p220 pt2 p208. Jacox,1994. [g12/99]
|
||
|
- name: CO
|
||
|
composition: {C: 1, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [1.489045326e+04, -292.2285939, 5.72452717, -8.17623503e-03, 1.456903469e-05,
|
||
|
-1.087746302e-08, 3.027941827e-12, -1.303131878e+04, -7.85924135]
|
||
|
- [4.61919725e+05, -1944.704863, 5.91671418, -5.66428283e-04, 1.39881454e-07,
|
||
|
-1.787680361e-11, 9.62093557e-16, -2466.261084, -13.87413108]
|
||
|
- [8.86866296e+08, -7.50037784e+05, 249.5474979, -0.039563511, 3.29777208e-06,
|
||
|
-1.318409933e-10, 1.998937948e-15, 5.70142113e+06, -2060.704786]
|
||
|
note: Gurvich,1979 pt1 p25 pt2 p29. [tpis79]
|
||
|
- name: COCL
|
||
|
composition: {C: 1, O: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.51317574e+04, -596.918967, 8.32767135, -7.05613259e-03, 1.313150734e-05,
|
||
|
-1.037059653e-08, 3.033665179e-12, -705.277032, -15.80716775]
|
||
|
- [3.44372024e+05, -1793.14347, 8.3927559, -5.37476959e-04, 9.11355571e-08,
|
||
|
-3.111441728e-12, -2.040435218e-16, 6914.47015, -19.98919104]
|
||
|
note: Gurvich,1991 pt1 p118 pt2 p91. [tpis91]
|
||
|
- name: COCL2
|
||
|
composition: {C: 1, O: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [9.31932145e+04, -1577.971273, 12.08353907, -4.80901561e-03, 7.68847732e-06,
|
||
|
-5.8588412e-09, 1.687786559e-12, -2.054252334e+04, -38.3476732]
|
||
|
- [-2.545881891e+04, -1305.958516, 10.92922584, -3.60121016e-04, 7.78701765e-08,
|
||
|
-8.79245203e-12, 4.02869661e-16, -2.21984734e+04, -32.3330345]
|
||
|
note: Gurvich,1991 pt1 p119 pt2 p92. [tpis91]
|
||
|
- name: COFCL
|
||
|
composition: {C: 1, O: 1, F: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [7.2621739e+04, -1019.738175, 7.29091199, 7.42069171e-03, -7.90254808e-06,
|
||
|
4.20942765e-09, -9.3144129e-13, -4.80438646e+04, -13.16923671]
|
||
|
- [-5.31688791e+04, -1581.009678, 11.12696501, -4.3730008e-04, 9.46419071e-08,
|
||
|
-1.069291346e-11, 4.90175664e-16, -4.59966723e+04, -35.25879824]
|
||
|
note: Gurvich,1991 pt1 p146 pt2 p120. [tpis91]
|
||
|
- name: COF2
|
||
|
composition: {C: 1, O: 1, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [5.26339315e+04, -461.860339, 2.774114516, 0.01831931082, -2.130172554e-05,
|
||
|
1.266924542e-08, -3.101675983e-12, -7.5642551e+04, 9.46718146]
|
||
|
- [-4.07380685e+04, -1974.009812, 11.40363654, -5.43711147e-04, 1.175232744e-07,
|
||
|
-1.326564192e-11, 6.07677213e-16, -6.90779541e+04, -40.09695]
|
||
|
note: Gurvich,1991 pt1 p89 pt2 p66. [tpis91]
|
||
|
- name: COHCL
|
||
|
composition: {C: 1, O: 1, H: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [6332.94687, 81.2036559, 1.374648391, 0.01650970564, -1.692917241e-05,
|
||
|
9.68404683e-09, -2.37446939e-12, -2.12035658e+04, 19.3837965]
|
||
|
- [8.31895285e+05, -4416.87084, 12.70661114, -9.36140863e-04, 1.855335611e-07,
|
||
|
-1.958378539e-11, 8.51204683e-16, 4330.49644, -51.45071542]
|
||
|
note: Gurvich,1991 pt1 p134 pt2 p106. [tpis91]
|
||
|
- name: COHF
|
||
|
composition: {C: 1, O: 1, H: 1, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.5858285e+04, 1048.202675, -4.77657422, 0.03080719931, -3.4158959e-05,
|
||
|
2.034926806e-08, -5.05419462e-12, -5.08598373e+04, 52.3224741]
|
||
|
- [8.57885316e+05, -4791.95912, 12.93975218, -1.018285299e-03, 2.021278474e-07,
|
||
|
-2.136698091e-11, 9.29958891e-16, -1.878933107e+04, -55.2744914]
|
||
|
note: Gurvich,1991 pt1 p106 pt2 p80. [tpis91]
|
||
|
- name: CO2
|
||
|
composition: {C: 1, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [4.94365054e+04, -626.411601, 5.30172524, 2.503813816e-03, -2.127308728e-07,
|
||
|
-7.68998878e-10, 2.849677801e-13, -4.52819846e+04, -7.04827944]
|
||
|
- [1.176962419e+05, -1788.791477, 8.29152319, -9.22315678e-05, 4.86367688e-09,
|
||
|
-1.891053312e-12, 6.33003659e-16, -3.90835059e+04, -26.52669281]
|
||
|
- [-1.544423287e+09, 1.016847056e+06, -256.140523, 0.0336940108, -2.181184337e-06,
|
||
|
6.99142084e-11, -8.8423515e-16, -8.04321451e+06, 2254.177493]
|
||
|
note: Gurvich,1991 pt1 p27 pt2 p24. [g 9/99]
|
||
|
- name: COOH
|
||
|
composition: {C: 1, O: 2, H: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.128380671e+04, 377.517943, -0.599255041, 0.02181894272, -2.425918417e-05,
|
||
|
1.451245206e-08, -3.59623338e-12, -2.841042565e+04, 29.34561769]
|
||
|
- [9.29318873e+05, -4483.03057, 12.42199567, -7.46313964e-04, 1.332996131e-07,
|
||
|
-1.28271055e-11, 5.1379979e-16, -851.823268, -50.6806551]
|
||
|
note: Gurvich,1991 pt1 p60 pt2 p46. [tpis91]
|
||
|
- name: C2
|
||
|
composition: {C: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [5.55963451e+05, -9980.12644, 66.8162037, -0.1743432724, 2.448523051e-04,
|
||
|
-1.70346758e-07, 4.68452773e-11, 1.445869634e+05, -344.82297]
|
||
|
- [-9.68926793e+05, 3561.09299, -0.506413893, 2.945154879e-03, -7.13944119e-07,
|
||
|
8.67065725e-11, -4.07690681e-15, 7.68179683e+04, 33.3998524]
|
||
|
- [6.31514592e+06, 1.365420661e+04, -3.99690367, 1.937561376e-03, -1.58444658e-07,
|
||
|
5.52086166e-12, -7.25373534e-17, 9387.02499, 66.1432992]
|
||
|
note: Gurvich,1991 pt1 p9 pt2 p8. [tpis91]
|
||
|
- name: C2CL
|
||
|
composition: {C: 2, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4.72588941e+04, -898.022361, 9.01687715, -6.33378283e-03, 1.08706005e-05,
|
||
|
-8.08906892e-09, 2.248275223e-12, 6.7022157e+04, -23.54893403]
|
||
|
- [2.137368408e+05, -1630.519518, 8.62349025, -4.25351786e-04, 9.04001864e-08,
|
||
|
-1.007541495e-11, 4.57076475e-16, 7.17109328e+04, -24.13014598]
|
||
|
note: Gurvich,1991 pt1 p112 pt2 p85. [tpis91]
|
||
|
- name: C2CL2
|
||
|
composition: {C: 2, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.87116873e+04, -933.687021, 11.19377832, -3.74628738e-03, 6.77047135e-06,
|
||
|
-4.91038745e-09, 1.299068486e-12, 2.948153174e+04, -33.1072353]
|
||
|
- [2.96199539e+05, -2044.290845, 11.87529729, -5.11503134e-04, 1.072666588e-07,
|
||
|
-1.183417569e-11, 5.32653048e-16, 3.6368025e+04, -40.0082605]
|
||
|
note: Hf:Manion,2002. Gurvich,1991 pt1 p114 pt2 p86. [g 5/02]
|
||
|
- name: C2CL3
|
||
|
composition: {C: 2, Cl: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [4.67501604e+04, -885.101964, 9.03227055, 0.01242122796, -1.554614347e-05,
|
||
|
9.51388712e-09, -2.341473263e-12, 2.495863399e+04, -17.79070154]
|
||
|
- [-2.204028219e+05, -1072.926248, 13.78367377, -3.093322915e-04, 6.77752895e-08,
|
||
|
-7.72730182e-12, 3.56669022e-16, 2.431020015e+04, -43.42161815]
|
||
|
note: Gurvich,1991 pt1 p114 pt2 p87. [tpis91]
|
||
|
- name: C2CL4
|
||
|
composition: {C: 2, Cl: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.7462575e+04, -848.177439, 10.09156041, 0.01845463807, -2.390899731e-05,
|
||
|
1.514828471e-08, -3.84111995e-12, -1598.289063, -23.68079134]
|
||
|
- [-3.001289625e+05, -1132.413909, 16.83073063, -3.28882017e-04, 7.2209754e-08,
|
||
|
-8.24541776e-12, 3.81015471e-16, -2292.758158, -59.8016442]
|
||
|
note: Hf:Manion,2002. Gurvich,1991 pt1 p115 pt2 p88. [g 5/02]
|
||
|
- name: C2CL6
|
||
|
composition: {C: 2, Cl: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.593451902e+05, -2606.697262, 20.28011918, 0.01769364625, -3.133104894e-05,
|
||
|
2.389395021e-08, -6.89303766e-12, -9038.00704, -79.5307301]
|
||
|
- [-5.57735194e+05, -497.657679, 22.37042798, -1.477797229e-04, 3.25764146e-08,
|
||
|
-3.72721807e-12, 1.723860648e-16, -2.335217699e+04, -83.8173691]
|
||
|
note: Hf:Manion,2002. Gurvich,1991 pt1 p117 pt2 p90. [g 5/02]
|
||
|
- name: C2F
|
||
|
composition: {C: 2, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.249797213e+04, -348.387675, 5.75508435, 8.52868538e-04, 2.353546435e-06,
|
||
|
-2.804737097e-09, 9.08357564e-13, 4.28152531e+04, -6.43720096]
|
||
|
- [2.898776676e+05, -2016.644658, 8.87504571, -5.16684113e-04, 1.092094306e-07,
|
||
|
-1.212216787e-11, 5.48228768e-16, 5.24128792e+04, -27.7308958]
|
||
|
note: Gurvich,1991 pt1 p81 pt2 p59. [tpis91]
|
||
|
- name: C2FCL
|
||
|
composition: {C: 2, F: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.697675344e+04, -741.440318, 9.6296043, -3.86554493e-04, 3.003347997e-06,
|
||
|
-2.710191661e-09, 7.73758689e-13, 5500.62039, -25.15774889]
|
||
|
- [3.47145489e+05, -2348.4611, 12.06875617, -5.80469823e-04, 1.21273434e-07,
|
||
|
-1.334214186e-11, 5.99255661e-16, 1.502061224e+04, -42.52445687]
|
||
|
note: Gurvich,1991 pt1 p141 pt2 p113. [tpis91]
|
||
|
- name: C2FCL3
|
||
|
composition: {C: 2, F: 1, Cl: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.237282217e+04, -470.396184, 7.58162179, 0.02305727066, -2.792144322e-05,
|
||
|
1.679699826e-08, -4.07757244e-12, -2.031333976e+04, -9.274637513]
|
||
|
- [-2.829505545e+05, -1473.853145, 17.07879074, -4.26521339e-04, 9.35719985e-08,
|
||
|
-1.067932796e-11, 4.93326161e-16, -1.738433314e+04, -61.97054796]
|
||
|
note: Gurvich,1991 pt1 p145 pt2 p119. [tpis91]
|
||
|
- name: C2F2
|
||
|
composition: {C: 2, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.776313572e+04, -611.328094, 8.6636068, 9.15638121e-04, 2.363808425e-06,
|
||
|
-2.753750054e-09, 8.71393597e-13, -1.649611017e+04, -21.65150307]
|
||
|
- [4.19389094e+05, -2715.359989, 12.30403413, -6.64930554e-04, 1.385254301e-07,
|
||
|
-1.520813764e-11, 6.81982103e-16, -4179.22194, -46.7038623]
|
||
|
note: Gurvich,1991 pt1 p82 pt2 p60. [tpis91]
|
||
|
- name: C2F2CL2
|
||
|
composition: {C: 2, F: 2, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.150433214e+05, 2032.113595, -11.19750271, 0.083424514, -1.163698616e-04,
|
||
|
7.83309289e-08, -2.070004069e-11, -5.20825681e+04, 88.88322147]
|
||
|
- [-8.70256566e+05, 726.472448, 15.30689121, 3.045597224e-04, -7.04546804e-08,
|
||
|
8.28592434e-12, -3.89858107e-16, -5.20888871e+04, -49.98300753]
|
||
|
note: Gurvich,1991 pt1 p143 pt2 p115. Eql mixture of isomers. [tpis91]
|
||
|
- name: C2F3
|
||
|
composition: {C: 2, F: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.614775016e+04, 210.1767714, 2.32862508, 0.02368943293, -2.416431591e-05,
|
||
|
1.224916093e-08, -2.488670434e-12, -3.028566585e+04, 16.9960879]
|
||
|
- [-1.242603837e+05, -2137.292446, 14.55051371, -6.09389198e-04, 1.331427672e-07,
|
||
|
-1.515124358e-11, 6.98411206e-16, -1.977146179e+04, -54.2103987]
|
||
|
note: Gurvich,1991 pt1 p83 pt2 p61. [tpis91]
|
||
|
- name: C2F3CL
|
||
|
composition: {C: 2, F: 3, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-8122.27031, -157.4007092, 5.04181029, 0.02621692321, -2.843001445e-05,
|
||
|
1.537643979e-08, -3.36073067e-12, -6.35404995e+04, 2.792301872]
|
||
|
- [-2.162724659e+05, -2195.103372, 17.59605428, -6.28261729e-04, 1.37416661e-07,
|
||
|
-1.565004037e-11, 7.2183099e-16, -5.5151095e+04, -69.21931824]
|
||
|
note: Gurvich,1991 pt1 p142 pt2 p114. [tpis91]
|
||
|
- name: C2F4
|
||
|
composition: {C: 2, F: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-9991.53007, -129.1088427, 4.50422905, 0.0259202964, -2.63030872e-05,
|
||
|
1.316489777e-08, -2.625017169e-12, -8.09044708e+04, 3.27424147]
|
||
|
- [-1.629915758e+05, -2603.903955, 17.88488423, -7.39703801e-04, 1.61446034e-07,
|
||
|
-1.835820392e-11, 8.45764107e-16, -7.00637166e+04, -74.5416586]
|
||
|
note: Gurvich,1991 pt1 p84 pt2 p62. [tpis91]
|
||
|
- name: C2F6
|
||
|
composition: {C: 2, F: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.7953717e+04, 799.82764, -4.67156181, 0.0750145099, -9.8121161e-05,
|
||
|
6.31980759e-08, -1.622597311e-11, -1.675211878e+05, 50.537592]
|
||
|
- [-1.011551484e+06, -942.214071, 22.02553906, -1.31451875e-04, 1.8660453e-08,
|
||
|
-3.46711861e-12, 2.488311205e-16, -1.657434402e+05, -93.0216115]
|
||
|
note: Gurvich,1991 pt1 p86 pt2 p64. [g12/99]
|
||
|
- name: C2H
|
||
|
composition: {C: 2, H: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.343669487e+04, -506.797072, 7.77210741, -6.51233982e-03, 1.030117855e-05,
|
||
|
-5.88014767e-09, 1.226901861e-12, 6.89226999e+04, -18.71881626]
|
||
|
- [3.92233457e+06, -1.204751703e+04, 17.5617292, -3.65544294e-03, 6.98768543e-07,
|
||
|
-6.82516201e-11, 2.719262793e-15, 1.433266627e+05, -95.6163438]
|
||
|
note: Ervin, 1990. Jacox,1998. Peric,1990. Kanamori,1988. [g 6/01]
|
||
|
- name: C2HCL
|
||
|
composition: {C: 2, H: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.329784931e+05, -2174.542005, 14.97980787, -0.012903432, 1.602596399e-05,
|
||
|
-9.15204743e-09, 2.021222995e-12, 3.60480126e+04, -59.5823675]
|
||
|
- [1.152149855e+06, -4461.20435, 12.81367818, -6.79739746e-04, 1.151395389e-07,
|
||
|
-1.046657798e-11, 3.94993917e-16, 5.233955e+04, -53.206617]
|
||
|
note: Hf:Manion,2002. Gurvich,1991 pt1 p129 pt2 p99. [g 5/02]
|
||
|
- name: C2HCL3
|
||
|
composition: {C: 2, H: 1, Cl: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.95923306e+04, -517.875604, 5.15503016, 0.02816922101, -3.62474115e-05,
|
||
|
2.392073843e-08, -6.3624007e-12, -1534.34508, 1.209377115]
|
||
|
- [6.04929824e+05, -4237.00319, 18.46274582, -8.13724326e-04, 1.551223511e-07,
|
||
|
-1.584645594e-11, 6.70100654e-16, 1.848292676e+04, -76.9837525]
|
||
|
note: Hf:Manion,2002. Gurvich,1991 pt1 p134 pt2 p105. [g 5/02]
|
||
|
- name: C2HF
|
||
|
composition: {C: 2, H: 1, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [9.16116911e+04, -1537.245636, 11.33665074, -4.62472931e-03, 5.87798546e-06,
|
||
|
-2.690992345e-09, 3.52471953e-13, 1.08590282e+04, -40.2399438]
|
||
|
- [1.234347179e+06, -4819.58196, 13.02337752, -7.49543582e-04, 1.285452942e-07,
|
||
|
-1.184559365e-11, 4.53678476e-16, 3.23681171e+04, -56.4079182]
|
||
|
note: Gurvich,1991 pt1 p99 pt2 p73. [tpis91]
|
||
|
- name: C2HFCL2
|
||
|
composition: {C: 2, H: 1, F: 1, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.117399823e+04, -136.9505457, 1.176399869, 0.040807766, -5.4181378e-05,
|
||
|
3.61360066e-08, -9.62586235e-12, -2.115142871e+04, 21.4643316]
|
||
|
- [4.07124352e+05, -3808.20452, 18.2114405, -7.27896606e-04, 1.381532849e-07,
|
||
|
-1.405342513e-11, 5.92000972e-16, -2676.849943, -75.67353567]
|
||
|
note: Gurvich,1991 pt1 p155 pt2 p133. Eql mixture of isomers. [tpis91]
|
||
|
- name: C2HF2CL
|
||
|
composition: {C: 2, H: 1, F: 2, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.704437675e+05, -1667.236861, 4.7887885, 0.0444483001, -7.32219777e-05,
|
||
|
5.62934755e-08, -1.654638029e-11, -3.29180976e+04, -5.78859364]
|
||
|
- [5.8303747e+05, -3810.31741, 17.99003171, -5.88821086e-04, 1.002861284e-07,
|
||
|
-9.1497881e-12, 3.45998516e-16, -2.205875409e+04, -75.90948533]
|
||
|
note: Gurvich,1991 pt1 p153 pt2 p129. 1,1 cis & trans in equil. [tpis91]
|
||
|
- name: C2HF3
|
||
|
composition: {C: 2, H: 1, F: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.410969036e+04, 368.762492, -1.144797568, 0.0395630602, -4.60200136e-05,
|
||
|
2.785149385e-08, -6.90376008e-12, -6.22641033e+04, 32.8966169]
|
||
|
- [6.91741378e+05, -5260.30164, 19.15276614, -1.072493938e-03, 2.099276744e-07,
|
||
|
-2.195126633e-11, 9.4727024e-16, -3.24764021e+04, -87.5045695]
|
||
|
note: Gurvich,1991 pt1 p105 pt2 p79. [tpis91]
|
||
|
- name: C2H2,acetylene
|
||
|
composition: {C: 2, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.598112089e+05, -2216.644118, 12.65707813, -7.97965108e-03, 8.05499275e-06,
|
||
|
-2.433307673e-09, -7.52923318e-14, 3.71261906e+04, -52.443389]
|
||
|
- [1.71384741e+06, -5929.10666, 12.36127943, 1.314186993e-04, -1.362764431e-07,
|
||
|
2.712655786e-11, -1.302066204e-15, 6.26657897e+04, -58.1896059]
|
||
|
note: Hf:TRC(10/93) w-3040. Gurvich,1991 pt1 p47 pt2 p39. [g 1/91]
|
||
|
- name: C2H2,vinylidene
|
||
|
composition: {C: 2, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.466042239e+04, 278.9475593, 1.276229776, 0.01395015463, -1.475702649e-05,
|
||
|
9.47629811e-09, -2.567602217e-12, 4.73611018e+04, 16.58225704]
|
||
|
- [1.940838725e+06, -6892.71815, 13.39582494, -9.36896867e-04, 1.470804368e-07,
|
||
|
-1.220040365e-11, 4.12239166e-16, 9.10711293e+04, -63.3750293]
|
||
|
note: Chen,1989. Osamura,1981. [g 5/01]
|
||
|
- name: C2H2CL2
|
||
|
composition: {C: 2, H: 2, Cl: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.203724514e+04, 462.903119, -1.318184584, 0.039304496, -4.85152902e-05,
|
||
|
3.17841146e-08, -8.47693841e-12, -3251.80686, 34.89218118]
|
||
|
- [1.561121185e+06, -7358.09635, 20.11869185, -1.310978834e-03, 2.411885716e-07,
|
||
|
-2.38416674e-11, 9.78541575e-16, 4.1222009e+04, -95.50252712]
|
||
|
note: Gurvich,1991 pt1 p130 pt2 p101. 1,1 cis & trans in equil. [tpis91]
|
||
|
- name: C2H2FCL
|
||
|
composition: {C: 2, H: 2, F: 1, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.260154427e+05, -2557.428772, 9.2362412, 0.02879408894, -5.16397547e-05,
|
||
|
4.25219103e-08, -1.311612713e-11, -8180.62784, -32.34787581]
|
||
|
- [1.527690968e+06, -6689.71223, 19.5055383, -1.040920895e-03, 1.780587502e-07,
|
||
|
-1.633098515e-11, 6.21346556e-16, 1.705266451e+04, -91.94078301]
|
||
|
note: Gurvich,1991 pt1 p150 pt2 p125. 1,1 cis & trans in equil. [tpis91]
|
||
|
- name: C2H2F2
|
||
|
composition: {C: 2, H: 2, F: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [5.70293581e+04, -676.28604, 4.11741171, 0.01822618762, -6.86133154e-06,
|
||
|
-3.29575674e-09, 2.180965597e-12, -3.83865078e+04, 1.487528685]
|
||
|
- [-8.22719275e+05, -2915.718833, 18.30163995, -1.039630129e-03, 2.546725128e-07,
|
||
|
-3.157578705e-11, 1.55154096e-15, -3.110028589e+04, -84.008347]
|
||
|
note: Gurvich,1991 pt1 p101 pt2 p75. 1,1 cis & trans in equil. [tpis91]
|
||
|
- name: CH2CO,ketene
|
||
|
composition: {C: 2, H: 2, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.54959809e+04, -406.306283, 3.71892192, 0.01583501817, -1.726195691e-05,
|
||
|
1.157376959e-08, -3.30584263e-12, -5209.99258, 3.83960422]
|
||
|
- [2.013564915e+06, -8200.88746, 17.59694074, -1.464544521e-03, 2.695886969e-07,
|
||
|
-2.66567484e-11, 1.094204522e-15, 4.17777688e+04, -87.2580358]
|
||
|
note: 'D0(H2C=CO): Ruscic,1999. Duncan,1987. [g 4/02]'
|
||
|
- name: O(CH)2O
|
||
|
composition: {C: 2, H: 2, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.292459698e+05, 3724.09805, -18.93769993, 0.0751174414, -8.08385542e-05,
|
||
|
4.35823319e-08, -9.36453933e-12, -4.45448601e+04, 132.702876]
|
||
|
- [2.678063593e+05, -4436.61748, 17.81696797, -7.09717378e-04, 1.272621878e-07,
|
||
|
-1.237226678e-11, 5.02505752e-16, -4479.60828, -81.5670064]
|
||
|
note: Glyoxal. Dorofeeva,2001. Hubner,1997. Zeleznik,2002. [g 3/02]
|
||
|
- name: HO(CO)2OH
|
||
|
composition: {C: 2, H: 2, O: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [3.072513274e+04, -391.617469, 3.17838864, 0.0374128975, -4.00975396e-05,
|
||
|
2.288662646e-08, -5.38677155e-12, -8.79794255e+04, 9.75109137]
|
||
|
- [1.805560696e+06, -9240.33315, 26.25742604, -1.418458557e-03, 2.526840574e-07,
|
||
|
-2.521005198e-11, 1.040036111e-15, -3.75428646e+04, -132.6879788]
|
||
|
note: Oxalic Acid, HO-CO-CO-OH. Dorofeeva,2001. [srd 01]
|
||
|
- name: C2H3,vinyl
|
||
|
composition: {C: 2, H: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.34789687e+04, 1064.104103, -6.40385706, 0.0393451548, -4.76004609e-05,
|
||
|
3.17007135e-08, -8.63340643e-12, 3.039122649e+04, 58.0922618]
|
||
|
- [2.718080093e+06, -1.030956829e+04, 18.36579807, -1.580131153e-03,
|
||
|
2.680594939e-07, -2.439003999e-11, 9.20909639e-16, 9.76505559e+04,
|
||
|
-97.6008686]
|
||
|
note: Radical. Ervin,1990. [g 7/01]
|
||
|
- name: CH2Br-COOH
|
||
|
composition: {C: 2, H: 3, Br: 1, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.83248479e+04, 1648.865353, -9.34953363, 0.0687963544, -8.37488077e-05,
|
||
|
5.40603842e-08, -1.423159923e-11, -5.54118762e+04, 81.654232]
|
||
|
- [2.48634985e+06, -1.140256346e+04, 27.56020307, -1.84318701e-03, 3.26539274e-07,
|
||
|
-3.122663159e-11, 1.223452495e-15, 1.837013127e+04, -142.0040888]
|
||
|
note: Bromoacetic Acid. Dorofeeva,2001. [srd 01]
|
||
|
- name: C2H3CL
|
||
|
composition: {C: 2, H: 3, Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.68889613e+04, 854.510555, -6.51496811, 0.0494468209, -6.11775691e-05,
|
||
|
4.06729403e-08, -1.101392662e-11, -2069.321797, 59.2843553]
|
||
|
- [2.456178566e+06, -1.04745272e+04, 21.78736544, -1.816893523e-03,
|
||
|
3.29637403e-07, -3.21440071e-11, 1.302256512e-15, 6.34623129e+04,
|
||
|
-114.9890773]
|
||
|
note: Hf:Manion,2002. Gurvich,1991 pt1 p129 pt2 p100. [g 5/02]
|
||
|
- name: CH2CL-COOH
|
||
|
composition: {C: 2, H: 3, Cl: 1, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.122506431e+05, 2168.288546, -12.27791221, 0.0751438806, -9.08315849e-05,
|
||
|
5.81236398e-08, -1.51824744e-11, -6.3143145e+04, 96.9438971]
|
||
|
- [2.472881709e+06, -1.152275613e+04, 27.66275288, -1.88642952e-03,
|
||
|
3.36177259e-07, -3.23126806e-11, 1.273273865e-15, 1.3703848e+04, -144.3191119]
|
||
|
note: Chloroacetic Acid. Dorofeeva,2001. [srd 01]
|
||
|
- name: C2H3F
|
||
|
composition: {C: 2, H: 3, F: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.57913496e+04, 1411.541724, -10.21500877, 0.0577581657, -7.08067749e-05,
|
||
|
4.64085076e-08, -1.240455865e-11, -2.402788827e+04, 78.6082839]
|
||
|
- [2.47883234e+06, -1.075932307e+04, 21.94796688, -1.86911411e-03, 3.39528067e-07,
|
||
|
-3.31538293e-11, 1.345081799e-15, 4.56345555e+04, -118.0410277]
|
||
|
note: Gurvich,1991 pt1 p100 pt2 p74. [tpis91]
|
||
|
- name: CH3CN
|
||
|
composition: {C: 2, H: 3, N: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-9.96598838e+04, 1739.278534, -7.89842082, 0.0429489432, -4.49997388e-05,
|
||
|
2.717105086e-08, -7.02611759e-12, -1461.161333, 68.52508274]
|
||
|
- [2.923231393e+06, -1.233792258e+04, 23.24477222, -2.411565845e-03,
|
||
|
4.62215717e-07, -4.74060124e-11, 2.010639467e-15, 8.05856555e+04,
|
||
|
-129.2249102]
|
||
|
note: Acetonitrile. TRC(6/93) w9270. Koga,1984. Pavone,1990. [g 9/00]
|
||
|
- name: CH3CO,acetyl
|
||
|
composition: {C: 2, H: 3, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.19389413e+04, 1464.465167, -6.63227613, 0.0410846838, -4.22625664e-05,
|
||
|
2.485766819e-08, -6.29255848e-12, -9309.37081, 64.2289762]
|
||
|
- [2.48538815e+06, -1.120714204e+04, 22.77525438, -2.31426055e-03, 4.53618917e-07,
|
||
|
-4.74263555e-11, 2.044663903e-15, 6.38008841e+04, -121.5350925]
|
||
|
note: Radical. Hf:Niiranen,1992. Nimlos,1989. [g 6/96]
|
||
|
- name: C2H4
|
||
|
composition: {C: 2, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.163605836e+05, 2554.85151, -16.09746428, 0.0662577932, -7.88508186e-05,
|
||
|
5.12522482e-08, -1.370340031e-11, -6176.19107, 109.3338343]
|
||
|
- [3.40876367e+06, -1.374847903e+04, 23.65898074, -2.423804419e-03,
|
||
|
4.43139566e-07, -4.35268339e-11, 1.775410633e-15, 8.82042938e+04,
|
||
|
-137.1278108]
|
||
|
note: TRC(4/88) w2600. Chao,1975. Knippers,1985. [g 1/00]
|
||
|
- name: C2H4O,ethylen-o
|
||
|
composition: {C: 2, H: 4, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.728233345e+05, 3816.6788, -26.29851977, 0.1014103162, -1.240578373e-04,
|
||
|
8.03404035e-08, -2.120942544e-11, -2.437519333e+04, 165.4885056]
|
||
|
- [3.151809957e+06, -1.423646316e+04, 27.08080476, -2.606238456e-03,
|
||
|
4.85389193e-07, -4.85214476e-11, 2.011778721e-15, 7.66256144e+04,
|
||
|
-156.3952401]
|
||
|
note: Ethylene Oxide. Shimanouchi,1972. Chase,1998 9/65. [g 8/88]
|
||
|
- name: CH3CHO,ethanal
|
||
|
composition: {C: 2, H: 4, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.373904369e+05, 2559.937679, -13.40470172, 0.0592212862, -6.24000605e-05,
|
||
|
3.70332441e-08, -9.34269741e-12, -3.31873131e+04, 100.7417652]
|
||
|
- [3.32117659e+06, -1.449719957e+04, 27.08421279, -2.879320054e-03,
|
||
|
5.55630992e-07, -5.73267488e-11, 2.443965239e-15, 6.50775564e+04,
|
||
|
-153.6236027]
|
||
|
note: Hf:TRC (6/78) w5300. Chao,1986. [g 8/88]
|
||
|
- name: CH3COOH
|
||
|
composition: {C: 2, H: 4, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.21919198e+04, 1196.329795, -8.70582402, 0.0569625759, -5.75788716e-05,
|
||
|
3.35211522e-08, -8.61443823e-12, -5.84011287e+04, 72.8241392]
|
||
|
- [2.103514223e+06, -1.467822192e+04, 33.8280283, -5.69485868e-03, 1.343221353e-06,
|
||
|
-1.606041158e-10, 7.65279425e-15, 2.924228407e+04, -193.527885]
|
||
|
note: Acetic Acid. Chao,1978. [g 6/00]
|
||
|
- name: OHCH2COOH
|
||
|
composition: {C: 2, H: 4, O: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.13897858e+05, 5693.06877, -36.8516029, 0.1563502811, -2.039487993e-04,
|
||
|
1.340232412e-07, -3.50913026e-11, -9.80164009e+04, 226.9492355]
|
||
|
- [1.946628253e+06, -9804.0202, 28.44111243, -7.87640475e-04, 6.41627595e-08,
|
||
|
1.069321262e-12, -3.23717828e-16, -1.69465047e+04, -147.4109363]
|
||
|
note: Glycolic Acid. Dorofeeva,2001. [srd 01]
|
||
|
- name: C2H5
|
||
|
composition: {C: 2, H: 5}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.411312551e+05, 2714.285088, -15.34977725, 0.0645167258, -7.25914396e-05,
|
||
|
4.59911601e-08, -1.218367535e-11, 598.141884, 109.096652]
|
||
|
- [4.1692204e+06, -1.662982142e+04, 27.95442134, -3.051715761e-03, 5.68516004e-07,
|
||
|
-5.6828636e-11, 2.355648561e-15, 1.137010087e+05, -163.9357995]
|
||
|
note: Chen,1990. [g 7/00]
|
||
|
- name: C2H5Br
|
||
|
composition: {C: 2, H: 5, Br: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.374172662e+05, 2861.429418, -18.24108956, 0.085662306, -1.047174473e-04,
|
||
|
6.90607457e-08, -1.862276022e-11, -2.198480205e+04, 125.8435579]
|
||
|
- [2.378649403e+06, -1.267033647e+04, 27.77558646, -2.010898783e-03,
|
||
|
4.43608341e-07, -5.34819809e-11, 2.63983585e-15, 6.41406205e+04, -152.8277085]
|
||
|
note: Bromoethane. TRC(6/79) tuvw7650. [n 6/79]
|
||
|
- name: C2H6
|
||
|
composition: {C: 2, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.862044161e+05, 3406.19186, -19.51705092, 0.0756583559, -8.20417322e-05,
|
||
|
5.0611358e-08, -1.319281992e-11, -2.70293289e+04, 129.8140496]
|
||
|
- [5.02578213e+06, -2.033022397e+04, 33.2255293, -3.83670341e-03, 7.23840586e-07,
|
||
|
-7.3191825e-11, 3.065468699e-15, 1.11596395e+05, -203.9410584]
|
||
|
note: Ethane. Pamidimukkala,1982. [g 7/00]
|
||
|
- name: CH3N2CH3
|
||
|
composition: {C: 2, H: 6, N: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.73849232e+05, 5880.45313, -29.86398524, 0.1087380861, -1.167950177e-04,
|
||
|
6.91689489e-08, -1.719950055e-11, -1.189984084e+04, 194.8246321]
|
||
|
- [4.99335709e+06, -2.160996161e+04, 39.6444992, -4.19645011e-03, 8.02336198e-07,
|
||
|
-8.21226002e-11, 3.47723744e-15, 1.44996261e+05, -237.2109745]
|
||
|
note: Azomethane. Pamidumukkala,1982. [g 8/88]
|
||
|
- name: C2H5OH
|
||
|
composition: {C: 2, H: 6, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.342791392e+05, 4479.18055, -27.44817302, 0.1088679162, -1.305309334e-04,
|
||
|
8.4373464e-08, -2.234559017e-11, -5.022229e+04, 176.4829211]
|
||
|
- [4.69481765e+06, -1.929798213e+04, 34.4758404, -3.23616598e-03, 5.78494772e-07,
|
||
|
-5.56460027e-11, 2.2262264e-15, 8.60162271e+04, -203.4801732]
|
||
|
note: Hf:TRC(6/87) w5030. Chao,1986. [g 8/88]
|
||
|
- name: CH3OCH3
|
||
|
composition: {C: 2, H: 6, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.693103242e+05, 4300.70971, -21.52788028, 0.0813183339, -8.29567132e-05,
|
||
|
4.80191151e-08, -1.188699808e-11, -4.41023709e+04, 146.7666934]
|
||
|
- [4.93357719e+06, -2.083094065e+04, 36.2905061, -4.10835164e-03, 7.90322031e-07,
|
||
|
-8.13143563e-11, 3.45816611e-15, 1.013301012e+05, -218.5447466]
|
||
|
note: Dimethyl ether. Hf:TRC(6/91) w6040. Chao,1986. [g 7/00]
|
||
|
- name: CH3O2CH3
|
||
|
composition: {C: 2, H: 6, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.285784757e+05, 3820.14257, -19.76647823, 0.0884074386, -9.64128456e-05,
|
||
|
5.90720083e-08, -1.526491225e-11, -3.49201696e+04, 138.6769151]
|
||
|
- [5.31636847e+06, -2.221267874e+04, 40.3433509, -4.61274809e-03, 8.7929872e-07,
|
||
|
-9.06822119e-11, 3.86566489e-15, 1.161596028e+05, -239.5296055]
|
||
|
note: Dimethyl peroxide, CH3-O-O-CH3. Dorofeeva,2001. [srd 01]
|
||
|
- name: CCN
|
||
|
composition: {C: 2, N: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.696281385e+04, 98.3789163, 3.81266294, 5.34689423e-03, -2.473598508e-06,
|
||
|
-3.73056422e-10, 4.48175686e-13, 9.48007257e+04, 5.553165572]
|
||
|
- [7.94867489e+04, -1344.786906, 8.30998646, -2.220105361e-04, 1.753683113e-08,
|
||
|
2.545998719e-12, -2.645649117e-16, 1.023187495e+05, -22.5979394]
|
||
|
note: Hf:Gurvich,1991 pt1 p222. Jacox,1998 p173. [g 7/00]
|
||
|
- name: CNC
|
||
|
composition: {C: 2, N: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.07519271e+04, 1007.523898, -1.576789967, 0.02052532634, -2.278935009e-05,
|
||
|
1.283362343e-08, -2.933174091e-12, 7.61332485e+04, 34.87094132]
|
||
|
- [-9.03131356e+04, -831.32365, 8.11473595, -2.447691991e-04, 5.39750877e-08,
|
||
|
-6.18398486e-12, 2.865172411e-16, 8.4518336e+04, -21.02937255]
|
||
|
note: CNC radical. Gurvich,1991 pt1 p221 pt2 p209. [tpis91]
|
||
|
- name: OCCN
|
||
|
composition: {C: 2, N: 1, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.428801128e+04, -552.586449, 8.58783809, -3.37938757e-03, 1.119841795e-05,
|
||
|
-1.008408053e-08, 3.086448751e-12, 2.599620066e+04, -16.59592428]
|
||
|
- [9.35909568e+05, -4441.07334, 13.68958451, -1.647526929e-03, 3.81986352e-07,
|
||
|
-3.94514858e-11, 1.509592679e-15, 4.95121691e+04, -54.1708359]
|
||
|
note: Cyanooxomethyl radical. Dorofeeva,2001. [srd 01]
|
||
|
- name: C2N2
|
||
|
composition: {C: 2, N: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.082404484e+05, -1928.137871, 15.53891898, -0.01821159329, 2.77884084e-05,
|
||
|
-1.899434373e-08, 4.94967772e-12, 4.44909759e+04, -60.90964741]
|
||
|
- [7.93442372e+05, -3997.37627, 13.1449743, -8.747782e-04, 2.059156733e-07,
|
||
|
-2.200469389e-11, 9.97448577e-16, 5.8636323e+04, -54.73201251]
|
||
|
note: Gurvich,1979 pt1 p195 pt2 p220. [tpis79]
|
||
|
- name: C2O
|
||
|
composition: {C: 2, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3959.92942, -111.7516348, 4.59396006, 3.71060202e-03, -7.01476018e-07,
|
||
|
-1.371129839e-09, 7.123854e-13, 3.41010974e+04, 0.46228056]
|
||
|
- [-6.34805659e+05, 1184.133091, 4.87917334, 1.757538773e-03, -3.95755227e-07,
|
||
|
3.98917994e-11, -1.546043135e-15, 2.489803938e+04, 0.980904059]
|
||
|
note: Hf:Gurvich,1991 pt1 p31. Jacox,1998. [g 8/00]
|
||
|
- name: C3
|
||
|
composition: {C: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [-4.35461448e+04, 666.018322, 1.451033157, 7.43451312e-03, -3.81015299e-06,
|
||
|
-2.336961396e-11, 4.40705453e-13, 9.6351702e+04, 20.25173297]
|
||
|
- [4.50809893e+06, -1.461033761e+04, 22.81974644, -8.54434061e-03, 2.146069341e-06,
|
||
|
-2.103867761e-10, 6.35158906e-15, 1.911976065e+05, -127.1869723]
|
||
|
- [1.539589859e+08, -2.089057498e+05, 76.8111121, -8.93905619e-03, 5.59403324e-07,
|
||
|
-1.743774353e-11, 2.181541208e-16, 1.650801763e+06, -608.169332]
|
||
|
note: Gurvich,1979 pt2 p23. [tpis79]
|
||
|
- name: C3H3,1-propynl
|
||
|
composition: {C: 3, H: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-6.50585935e+04, 1350.858921, -5.82543393, 0.0375661048, -3.73490334e-05,
|
||
|
2.117676603e-08, -5.13911325e-12, 4.65651053e+04, 57.8147755]
|
||
|
- [4.55065487e+06, -1.640574172e+04, 27.12605991, -4.47460038e-03, 1.037712415e-06,
|
||
|
-1.250211369e-10, 6.02658205e-15, 1.534087662e+05, -156.5931809]
|
||
|
note: TRC(4/98) tuvw3140. [n 4/98]
|
||
|
- name: C3H3,2-propynl
|
||
|
composition: {C: 3, H: 3}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [6.18857832e+04, -890.957867, 6.34755882, 0.01633173115, -1.949975695e-05,
|
||
|
1.417349778e-08, -4.19986632e-12, 4.27178583e+04, -12.31400729]
|
||
|
- [2.989723833e+06, -1.118954446e+04, 22.22225052, -2.068106902e-03,
|
||
|
4.12188364e-07, -4.43898059e-11, 1.970824701e-15, 1.061878289e+05,
|
||
|
-118.6744583]
|
||
|
note: TRC(4/98) tuvw3140. [n 4/98]
|
||
|
- name: C3H4,allene
|
||
|
composition: {C: 3, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.645155745e+04, 962.945781, -7.53232668, 0.0551821911, -6.73358512e-05,
|
||
|
4.53270905e-08, -1.251837614e-11, 1.772494269e+04, 61.5196976]
|
||
|
- [3.4793551e+06, -1.430412453e+04, 27.02534756, -2.557412369e-03, 4.70664675e-07,
|
||
|
-4.65168807e-11, 1.908219044e-15, 1.072312354e+05, -154.8846158]
|
||
|
note: TRC(4/84) w2750. Shimanouchi,1972 p115. Butcher,1973a. [g 2/00]
|
||
|
- name: C3H4,propyne
|
||
|
composition: {C: 3, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.5638844e+04, 832.81391, -4.07375944, 0.0411392961, -4.47044495e-05,
|
||
|
2.847458197e-08, -7.69529824e-12, 1.710206236e+04, 45.1672095]
|
||
|
- [3.71044142e+06, -1.489145507e+04, 27.32397127, -2.64526477e-03, 4.85830035e-07,
|
||
|
-4.79412848e-11, 1.964338121e-15, 1.104898462e+05, -156.7992462]
|
||
|
note: Hf:TRC(10/93) w3040. Trambarulo,1950. Shimanouchi,1972. [g 1/00]
|
||
|
- name: C3H4,cyclo-
|
||
|
composition: {C: 3, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.969520627e+04, 1505.379338, -14.18206573, 0.0764263296, -9.76558366e-05,
|
||
|
6.61200382e-08, -1.811251145e-11, 2.625631782e+04, 96.0463189]
|
||
|
- [3.16839958e+06, -1.371044699e+04, 26.64303646, -2.42040805e-03, 4.42799413e-07,
|
||
|
-4.3518202e-11, 1.775948955e-15, 1.133683702e+05, -152.2619086]
|
||
|
note: Dorofeeva,1986. [g 5/90]
|
||
|
- name: C3H5,allyl
|
||
|
composition: {C: 3, H: 5}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.31599614e+04, 1441.600907, -11.97014426, 0.0731979646, -9.06635785e-05,
|
||
|
6.07705945e-08, -1.658826363e-11, 1.23215746e+04, 85.6317324]
|
||
|
- [4.09457059e+06, -1.676676186e+04, 31.23006342, -2.885449982e-03,
|
||
|
5.21134354e-07, -5.05828422e-11, 2.039932554e-15, 1.185720481e+05,
|
||
|
-182.3070197]
|
||
|
note: Radical. Burcat,2001 p58. [g 3/01]
|
||
|
- name: C3H6,propylene
|
||
|
composition: {C: 3, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.912462174e+05, 3542.07424, -21.14878626, 0.0890148479, -1.001429154e-04,
|
||
|
6.26795939e-08, -1.637870781e-11, -1.529961824e+04, 140.7641382]
|
||
|
- [5.01762034e+06, -2.086084035e+04, 36.4415634, -3.88119117e-03, 7.27867719e-07,
|
||
|
-7.3212045e-11, 3.052176369e-15, 1.261245355e+05, -219.5715757]
|
||
|
note: Hf:TRC(4/88) w2600. Chao,1975. [g 2/00]
|
||
|
- name: C3H6,cyclo-
|
||
|
composition: {C: 3, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.56578777e+05, 4111.12987, -32.3344746, 0.1306337881, -1.645563833e-04,
|
||
|
1.095708326e-07, -2.956394783e-11, -1.245271686e+04, 193.1559109]
|
||
|
- [4.78500067e+06, -2.042118175e+04, 36.3149578, -3.56131944e-03, 6.47624124e-07,
|
||
|
-6.3284301e-11, 2.568705857e-15, 1.268274126e+05, -222.3729099]
|
||
|
note: Dorofeeva,1986. Butcher,1973b. [g 1/00]
|
||
|
- name: C3H6O,propylox
|
||
|
composition: {C: 3, H: 6, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.292808804e+05, 4495.75054, -29.41117945, 0.1213113827, -1.440060464e-04,
|
||
|
9.20205175e-08, -2.416278343e-11, -3.31769721e+04, 184.6878218]
|
||
|
- [4.78972999e+06, -2.106895971e+04, 39.5464773, -3.91092998e-03, 7.32553151e-07,
|
||
|
-7.35708597e-11, 3.0606185e-15, 1.12034454e+05, -237.2004192]
|
||
|
note: TRC(6/84) w6150. Swalen,1957. Oetting,1964. Villarreal,1975. [g
|
||
|
6/01]
|
||
|
- name: C3H6O,acetone
|
||
|
composition: {C: 3, H: 6, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.277802525e+05, 4215.28001, -24.15785316, 0.0990748332, -1.084940903e-04,
|
||
|
6.58335596e-08, -1.676046146e-11, -4.72624394e+04, 160.7926432]
|
||
|
- [5.00160192e+06, -2.170155542e+04, 39.6449399, -4.17994505e-03, 7.96242953e-07,
|
||
|
-8.12255805e-11, 3.42878096e-15, 1.015145028e+05, -236.8533477]
|
||
|
note: Chao,1986. Chao,1976. [g 6/97]
|
||
|
- name: C3H6O,propanal
|
||
|
composition: {C: 3, H: 6, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.655781702e+05, 4250.64045, -21.09249262, 0.0919425612, -1.004653044e-04,
|
||
|
6.13331482e-08, -1.576298535e-11, -4.45037105e+04, 145.6678605]
|
||
|
- [4.83093349e+06, -2.075451152e+04, 39.2485518, -4.095514e-03, 7.88169216e-07,
|
||
|
-8.10768408e-11, 3.43710543e-15, 9.94493788e+04, -231.6690627]
|
||
|
note: Hf:TRC(6/78) w5300. Chao,1986. Frankiss,1974. [g 1/02]
|
||
|
- name: C3H7,n-propyl
|
||
|
composition: {C: 3, H: 7}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.895337073e+05, 3949.51726, -26.06216089, 0.1121920441, -1.365292213e-04,
|
||
|
9.02366272e-08, -2.44105699e-11, -7227.87744, 167.3705556]
|
||
|
- [5.64651294e+06, -2.291087136e+04, 39.8727518, -4.10623287e-03, 7.56255777e-07,
|
||
|
-7.47826302e-11, 3.068983677e-15, 1.483006853e+05, -240.378119]
|
||
|
note: Radical. Tsang,1985. [g 7/01]
|
||
|
- name: C3H7,i-propyl
|
||
|
composition: {C: 3, H: 7}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.952063445e+05, 5294.4323, -31.05287013, 0.1143871563, -1.291752393e-04,
|
||
|
8.05784376e-08, -2.093908432e-11, -1.476815514e+04, 198.808236]
|
||
|
- [5.80700252e+06, -2.411219997e+04, 40.852884, -4.51785133e-03, 8.49942717e-07,
|
||
|
-8.57351434e-11, 3.58338396e-15, 1.54650405e+05, -248.7098372]
|
||
|
note: Radical. Tsang,1985. [g 9/85]
|
||
|
- name: C3H8
|
||
|
composition: {C: 3, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.433144337e+05, 4656.27081, -29.39466091, 0.1188952745, -1.376308269e-04,
|
||
|
8.81482391e-08, -2.342987994e-11, -3.54033527e+04, 184.1749277]
|
||
|
- [6.42073168e+06, -2.659791134e+04, 45.3435684, -5.02066392e-03, 9.47121694e-07,
|
||
|
-9.57540523e-11, 4.00967288e-15, 1.455582459e+05, -281.8374734]
|
||
|
note: Hf:TRC(10/85) w1350. Chao,1973. [g 2/00]
|
||
|
- name: C3H8O,1propanol
|
||
|
composition: {C: 3, H: 8, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.616973337e+05, 5192.37666, -32.9648116, 0.1354568128, -1.593156164e-04,
|
||
|
1.01949816e-07, -2.688552974e-11, -5.61285435e+04, 208.5024431]
|
||
|
- [6.30867212e+06, -2.642210376e+04, 47.1511259, -4.64251193e-03, 8.59346536e-07,
|
||
|
-8.68209182e-11, 3.64222401e-15, 1.255003155e+05, -285.9463804]
|
||
|
note: Hf:TRC(6/87) w5030. Chao,1986. [g 2/00]
|
||
|
- name: C3H8O,2propanol
|
||
|
composition: {C: 3, H: 8, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.38651024e+05, 6106.048, -37.9141804, 0.1530494531, -1.864354461e-04,
|
||
|
1.213257738e-07, -3.22043349e-11, -6.27995935e+04, 233.432261]
|
||
|
- [6.00107475e+06, -2.50587683e+04, 46.2209612, -4.27246631e-03, 7.69367877e-07,
|
||
|
-7.45058484e-11, 2.998959935e-15, 1.148518732e+05, -279.6132222]
|
||
|
note: Hf:TRC(6/87) w5030. Chao,1986. [g 2/00]
|
||
|
- name: CNCOCN
|
||
|
composition: {C: 3, N: 2, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.131052007e+05, -1978.834859, 16.26886148, -8.33080179e-03, 1.884126795e-05,
|
||
|
-1.530681099e-08, 4.41812473e-12, 3.68026169e+04, -59.6332711]
|
||
|
- [7.00050839e+05, -5085.99853, 19.46753161, -1.302851179e-03, 2.7535969e-07,
|
||
|
-3.056286034e-11, 1.382138451e-15, 5.5393366e+04, -86.275486]
|
||
|
note: Oxopropanedinitrile, NC-CO-CN. Dorofeeva,2001. [srd 01]
|
||
|
- name: C3O2
|
||
|
composition: {C: 3, O: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.579873382e+05, -2529.493506, 18.01761578, -0.01786032042, 2.978671986e-05,
|
||
|
-2.182900022e-08, 6.01379722e-12, -1121.054014, -72.7772117]
|
||
|
- [6.96869989e+05, -4624.73319, 16.63905725, -1.175486554e-03, 2.478106444e-07,
|
||
|
-2.745165984e-11, 1.239566766e-15, 1.252580069e+04, -72.7596878]
|
||
|
note: Hf:Chase,1998 p690 6/68. Shimanouchi,1977 p1083. [g 7/88]
|
||
|
- name: C4
|
||
|
composition: {C: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [3.9037805e+04, -894.828078, 10.50952925, -6.55289446e-03, 1.243940464e-05,
|
||
|
-8.64534137e-09, 2.263638846e-12, 1.266425869e+05, -30.77594475]
|
||
|
- [9.20068513e+05, -1530.3118, 6.0500692, 5.25274367e-03, -1.779154772e-06,
|
||
|
2.589873632e-10, -1.385553481e-14, 1.334389611e+05, -7.26114882]
|
||
|
- [-2.864752103e+07, 1.765535487e+04, 6.16659828, 8.09878903e-04, -6.65348381e-08,
|
||
|
2.504726897e-12, -3.58572418e-17, -2.082319291e+04, 4.33125892]
|
||
|
note: Gurvich,1991 pt1 p18 pt2 p16. [g tpis]
|
||
|
- name: C4H2,butadiyne
|
||
|
composition: {C: 4, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.467542569e+05, -3897.85564, 23.66080456, -0.02208077805, 2.78110114e-05,
|
||
|
-1.57734001e-08, 3.42316546e-12, 7.08690782e+04, -110.917356]
|
||
|
- [2.328179913e+06, -8925.18609, 21.14326883, -1.368871276e-03, 2.327503159e-07,
|
||
|
-2.124517624e-11, 8.05331302e-16, 1.057788416e+05, -108.8313574]
|
||
|
note: 1,3-Butadiyne. Dorofeeva,1991. [g 7/01]
|
||
|
- name: C4H4,1,3-cyclo-
|
||
|
composition: {C: 4, H: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.778428049e+04, 1768.176915, -17.57895171, 0.0938351292, -1.195524281e-04,
|
||
|
7.97808619e-08, -2.1527511e-11, 3.81162712e+04, 112.8478124]
|
||
|
- [2.991498949e+06, -1.416781502e+04, 30.01978876, -2.579200423e-03,
|
||
|
4.78999045e-07, -4.77532971e-11, 1.974923662e-15, 1.27466692e+05,
|
||
|
-172.7532057]
|
||
|
note: 1,3-Cyclobutadiene. Dorofeeva,1986. [g 8/00]
|
||
|
- name: C4H6,butadiene
|
||
|
composition: {C: 4, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-9.18113053e+04, 3312.57053, -29.85828611, 0.1479201147, -2.056618326e-04,
|
||
|
1.466496826e-07, -4.14528573e-11, -2077.309444, 178.0687329]
|
||
|
- [-2.361903188e+07, 5.65132337e+04, -32.7573832, 0.02293070572, -2.297106441e-06,
|
||
|
4.29259621e-11, 4.23676604e-15, -3.67135862e+05, 301.3437302]
|
||
|
note: 1,3-butadiene. TRC(10/92) tuvw2820. [n10/92]
|
||
|
- name: C4H6,1butyne
|
||
|
composition: {C: 4, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.59703997e+04, 1433.191711, -9.69121072, 0.0715000239, -8.1579678e-05,
|
||
|
5.29036497e-08, -1.435655372e-11, 1.184987013e+04, 76.6022536]
|
||
|
- [6.3644027e+06, -2.392087731e+04, 40.7375041, -3.17672649e-03, 1.199856984e-07,
|
||
|
3.20180251e-11, -2.854392633e-15, 1.634335546e+05, -246.0284791]
|
||
|
note: TRC(10/93) tuvw3040. [n10/93]
|
||
|
- name: C4H6,2butyne
|
||
|
composition: {C: 4, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.650756405e+05, 4490.72869, -24.00723889, 0.0981957955, -1.079717182e-04,
|
||
|
6.67555577e-08, -1.740766886e-11, -5328.36371, 159.5035268]
|
||
|
- [3.98130433e+06, -1.873032899e+04, 36.5456149, -2.369686378e-03, 3.99021181e-07,
|
||
|
-3.69870727e-11, 1.442072006e-15, 1.261460214e+05, -215.5866205]
|
||
|
note: TRC(10/93) tuvw3040. [n10/93]
|
||
|
- name: C4H6,cyclo-
|
||
|
composition: {C: 4, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.046707734e+05, 4919.47057, -37.5327816, 0.1497293031, -1.860139375e-04,
|
||
|
1.219909019e-07, -3.25407359e-11, -3915.95054, 223.3282138]
|
||
|
- [4.51736782e+06, -2.097311985e+04, 40.0803917, -3.94979398e-03, 7.44848499e-07,
|
||
|
-7.52975417e-11, 3.153253502e-15, 1.406469848e+05, -243.4836999]
|
||
|
note: Cyclobutene. Dorofeeva,1986. [g 8/00]
|
||
|
- name: C4H8,1-butene
|
||
|
composition: {C: 4, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.721492014e+05, 5100.07925, -31.8378625, 0.1317754442, -1.527359339e-04,
|
||
|
9.71476111e-08, -2.56020447e-11, -2.523096386e+04, 200.6932108]
|
||
|
- [6.25794861e+06, -2.660376305e+04, 47.6492005, -4.38326711e-03, 7.12883844e-07,
|
||
|
-5.99102084e-11, 2.051753504e-15, 1.569252657e+05, -291.3869761]
|
||
|
note: TRC(4/88) tuvw2600. [n 4/88]
|
||
|
- name: C4H8,cis2-buten
|
||
|
composition: {C: 4, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.773870877e+05, 5382.38404, -33.751881, 0.1322980623, -1.490975922e-04,
|
||
|
9.277722e-08, -2.408282948e-11, -2.715884347e+04, 211.4462085]
|
||
|
- [6.46101835e+06, -2.775376432e+04, 48.6353236, -4.86238635e-03, 8.4126261e-07,
|
||
|
-7.63389037e-11, 2.861702826e-15, 1.630856187e+05, -300.3105998]
|
||
|
note: Cis2-butene TRC(4/88) tuvw2600. [n 4/88]
|
||
|
- name: C4H8,tr2-butene
|
||
|
composition: {C: 4, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.59464411e+05, 5930.97208, -32.5582529, 0.125495778, -1.374705365e-04,
|
||
|
8.40734135e-08, -2.163047345e-11, -3.113296523e+04, 207.0081219]
|
||
|
- [6.44475809e+06, -2.750706151e+04, 48.7032938, -4.95244546e-03, 8.70013591e-07,
|
||
|
-8.01747171e-11, 3.052575093e-15, 1.612137505e+05, -300.4419156]
|
||
|
note: TRC(4/88) tuvw-2600. [n 4/88]
|
||
|
- name: C4H8,isobutene
|
||
|
composition: {C: 4, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.327205032e+05, 3941.99424, -22.24581184, 0.1012790864, -1.073194065e-04,
|
||
|
6.45469691e-08, -1.646330345e-11, -2.233766063e+04, 147.9597621]
|
||
|
- [6.48497099e+06, -2.732504764e+04, 48.3632108, -4.76800405e-03, 8.23387584e-07,
|
||
|
-7.449253e-11, 2.782303056e-15, 1.595941773e+05, -298.2986237]
|
||
|
note: TRC(4/88) tuvw2600. [n 4/88]
|
||
|
- name: C4H8,cyclo-
|
||
|
composition: {C: 4, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.047655983e+05, 6519.48273, -46.6298759, 0.1743593052, -2.090964176e-04,
|
||
|
1.343528679e-07, -3.5427274e-11, -2.700031171e+04, 273.8348195]
|
||
|
- [4.45621381e+06, -2.301018492e+04, 44.9244846, -3.080145176e-03, 5.31716526e-07,
|
||
|
-5.08107938e-11, 2.048919092e-15, 1.355487603e+05, -277.1801965]
|
||
|
note: Cyclobutane. Dorofeeva,1986. [g 8/00]
|
||
|
- name: (CH3COOH)2
|
||
|
composition: {C: 4, H: 8, O: 4}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.094720023e+05, 5983.3386, -35.7300292, 0.1662525587, -1.8838663e-04,
|
||
|
1.154939386e-07, -2.935166753e-11, -1.421493469e+05, 229.5855147]
|
||
|
- [6.57132759e+06, -3.03687072e+04, 62.5037667, -5.73262471e-03, 1.083461635e-06,
|
||
|
-1.09796359e-10, 4.60926338e-15, 6.3474266e+04, -373.455507]
|
||
|
note: Acetic acid dimer. Chao,1978. [g10/00]
|
||
|
- name: C4H9,n-butyl
|
||
|
composition: {C: 4, H: 9}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.239560407e+05, 4676.5541, -29.85424449, 0.1345493704, -1.60066035e-04,
|
||
|
1.045338096e-07, -2.812951048e-11, -1.525297704e+04, 190.1651559]
|
||
|
- [7.19868694e+06, -2.959241524e+04, 52.4204281, -5.44157244e-03, 9.91775837e-07,
|
||
|
-9.46445587e-11, 3.72948704e-15, 1.834566472e+05, -321.420917]
|
||
|
note: TRC(10/84) tuvw1940. [n10/84]
|
||
|
- name: C4H9,i-butyl
|
||
|
composition: {C: 4, H: 9}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.399461281e+05, 4697.44454, -30.8747256, 0.1391655831, -1.670233968e-04,
|
||
|
1.092423088e-07, -2.936209962e-11, -1.638151036e+04, 193.6662372]
|
||
|
- [6.75293606e+06, -2.837423721e+04, 51.4068761, -4.98239901e-03, 8.80150663e-07,
|
||
|
-8.12573869e-11, 3.099140009e-15, 1.74344848e+05, -314.9940745]
|
||
|
note: 2-methylpropyl. TRC(10/84) tuvw1940. [n10/84]
|
||
|
- name: C4H9,s-butyl
|
||
|
composition: {C: 4, H: 9}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.35106289e+05, 6312.94595, -40.0302526, 0.1563875047, -1.842331788e-04,
|
||
|
1.182727848e-07, -3.131156589e-11, -2.216045659e+04, 248.1295714]
|
||
|
- [7.22474435e+06, -3.035291099e+04, 52.8855183, -5.65208355e-03, 1.060032692e-06,
|
||
|
-1.066129835e-10, 4.44381096e-15, 1.883494279e+05, -325.571988]
|
||
|
note: 1-methylpropyl radical. Tsang,1985. [g 1/93]
|
||
|
- name: C4H9,t-butyl
|
||
|
composition: {C: 4, H: 9}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.72346195e+05, 8090.19877, -46.8367534, 0.1575300095, -1.686559436e-04,
|
||
|
9.98104013e-08, -2.487608823e-11, -3.31936741e+04, 289.4838706]
|
||
|
- [7.15106495e+06, -3.17122441e+04, 54.4251032, -6.39233116e-03, 1.241097612e-06,
|
||
|
-1.2872483e-10, 5.51261874e-15, 1.934506997e+05, -339.932529]
|
||
|
note: 1,1dimethylethyl radical. Tsang,1985. [g 1/93]
|
||
|
- name: C4H10,n-butane
|
||
|
composition: {C: 4, H: 10}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.17587254e+05, 6176.33182, -38.9156212, 0.1584654284, -1.860050159e-04,
|
||
|
1.199676349e-07, -3.20167055e-11, -4.54036339e+04, 237.9488665]
|
||
|
- [7.68232245e+06, -3.25605151e+04, 57.3673275, -6.19791681e-03, 1.180186048e-06,
|
||
|
-1.221893698e-10, 5.25063525e-15, 1.77452656e+05, -358.791876]
|
||
|
note: Hf:TRC(10/85) w1350. Chen,1975. [g12/00]
|
||
|
- name: C4H10,isobutane
|
||
|
composition: {C: 4, H: 10}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.83446933e+05, 7000.03964, -44.400269, 0.1746183447, -2.078195348e-04,
|
||
|
1.339792433e-07, -3.55168163e-11, -5.03401889e+04, 265.8966497]
|
||
|
- [7.52801892e+06, -3.20251706e+04, 57.00161, -6.06001309e-03, 1.143975809e-06,
|
||
|
-1.157061835e-10, 4.84604291e-15, 1.728500802e+05, -357.617689]
|
||
|
note: TRC(10/85) w1350. Chen,1975. [g 8/00]
|
||
|
- name: C4N2
|
||
|
composition: {C: 4, N: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [1.587802866e+05, -2987.184206, 23.48081602, -0.02607502448, 4.04283003e-05,
|
||
|
-2.804912444e-08, 7.39765205e-12, 7.50529947e+04, -101.757825]
|
||
|
- [1.167686152e+06, -6198.64418, 20.62070093, -1.518619449e-03, 3.16236168e-07,
|
||
|
-3.4699228e-11, 1.555154128e-15, 9.66740939e+04, -96.69734738]
|
||
|
note: Hf:TRC(12/93) w8992. Khanna,1987. Brown,1989. [g 6/01]
|
||
|
- name: C5
|
||
|
composition: {C: 5}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [-1.200801119e+04, -555.370291, 11.23828271, -4.34788452e-03, 1.73898749e-05,
|
||
|
-1.707945418e-08, 5.57454191e-12, 1.262404627e+05, -32.6230899]
|
||
|
- [2.172055356e+05, -2958.510027, 15.61080967, -8.20036192e-04, 1.776898025e-07,
|
||
|
-2.009853583e-11, 9.22267777e-16, 1.395208064e+05, -64.3307718]
|
||
|
- [3.26686396e+06, -2666.377675, 14.0838378, -6.62051214e-05, 4.09978945e-09,
|
||
|
-1.315689998e-13, 1.711940703e-18, 1.405413771e+05, -53.4935401]
|
||
|
note: Gurvich,1991 pt1 p20 pt2 p18. [g 8/00]
|
||
|
- name: C5H6,1,3cyclo-
|
||
|
composition: {C: 5, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.886259728e+05, 4738.22087, -38.8895801, 0.1667438533, -2.141149581e-04,
|
||
|
1.438132328e-07, -3.90647811e-11, -5667.02201, 227.9898557]
|
||
|
- [4.42847819e+06, -2.123547976e+04, 43.0981901, -3.91478346e-03, 7.31184701e-07,
|
||
|
-7.32724119e-11, 3.044403403e-15, 1.382542782e+05, -260.5959678]
|
||
|
note: 1,3-Cyclopentadiene. Pedley,1986 p90. Dorofeeva,1986. [g 5/90]
|
||
|
- name: C5H8,cyclo-
|
||
|
composition: {C: 5, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.631114588e+05, 5987.75349, -45.222446, 0.1804626339, -2.177216062e-04,
|
||
|
1.402022671e-07, -3.6990943e-11, -2.379504749e+04, 266.0136401]
|
||
|
- [4.5698481e+06, -2.406018294e+04, 48.8100646, -3.41305498e-03, 6.04700166e-07,
|
||
|
-5.92749578e-11, 2.44786539e-15, 1.413983093e+05, -298.9533527]
|
||
|
note: Cyclopentene. Hf:TRC(10/92) w2840. Dorofeeva,1986. [g 1/93]
|
||
|
- name: C5H10,1-pentene
|
||
|
composition: {C: 5, H: 10}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.34054813e+05, 9298.91738, -56.6779245, 0.2123100266, -2.57129829e-04,
|
||
|
1.666834304e-07, -4.43408047e-11, -4.79068218e+04, 339.60364]
|
||
|
- [3.74401497e+06, -2.104485321e+04, 47.3612699, -4.2442012e-04, -3.89897505e-08,
|
||
|
1.367074243e-11, -9.31319423e-16, 1.154091373e+05, -278.6177449]
|
||
|
note: TRC(4/87) tuvw2500. [n 4/87]
|
||
|
- name: C5H10,cyclo-
|
||
|
composition: {C: 5, H: 10}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.14111971e+05, 8627.5928, -62.0295998, 0.2259910921, -2.68230333e-04,
|
||
|
1.706289935e-07, -4.46405092e-11, -4.93152214e+04, 358.391623]
|
||
|
- [7.50193873e+06, -3.50586485e+04, 63.2248075, -6.94035658e-03, 1.337306593e-06,
|
||
|
-1.377905033e-10, 5.86735764e-15, 1.954925511e+05, -402.65509]
|
||
|
note: Cyclopentane. Dorofeeva,1986. [g 2/01]
|
||
|
- name: C5H11,pentyl
|
||
|
composition: {C: 5, H: 11}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.65371592e+05, 8564.22042, -52.9524289, 0.2094288859, -2.561602906e-04,
|
||
|
1.692755961e-07, -4.59678811e-11, -3.64170427e+04, 319.686224]
|
||
|
- [5.6972529e+06, -2.891706175e+04, 58.1102968, -3.59399501e-03, 4.41996763e-07,
|
||
|
-1.509664551e-11, -6.62696443e-16, 1.71700955e+05, -352.247712]
|
||
|
note: Radical. TRC(10/84) tuvw1941. [n10/84]
|
||
|
- name: C5H11,t-pentyl
|
||
|
composition: {C: 5, H: 11}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.15218198e+05, 9144.32783, -56.0239789, 0.1998204194, -2.239112591e-04,
|
||
|
1.375455547e-07, -3.52383305e-11, -4.03626661e+04, 340.2811]
|
||
|
- [8.60210826e+06, -3.80520577e+04, 66.4969037, -7.53386063e-03, 1.451612787e-06,
|
||
|
-1.495593207e-10, 6.36802233e-15, 2.281858805e+05, -416.940855]
|
||
|
note: 1,1-dimethylpropyl radical. Tsang,1985. [g 1/93]
|
||
|
- name: C5H12,n-pentane
|
||
|
composition: {C: 5, H: 12}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.768894625e+05, 5834.28347, -36.1754148, 0.1533339707, -1.528395882e-04,
|
||
|
8.191092e-08, -1.792327902e-11, -4.66537525e+04, 226.5544053]
|
||
|
- [-2.530779286e+06, -8972.59326, 45.3622326, -2.626989916e-03, 3.135136419e-06,
|
||
|
-5.31872894e-10, 2.886896868e-14, 1.484616529e+04, -251.6550384]
|
||
|
note: TRC(10/85) tuvw1350. [n10/85]
|
||
|
- name: C5H12,i-pentane
|
||
|
composition: {C: 5, H: 12}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.23190339e+05, 6497.1891, -36.8112697, 0.1532424729, -1.548790714e-04,
|
||
|
8.74989712e-08, -2.07054771e-11, -5.15541659e+04, 230.9518218]
|
||
|
- [1.156888594e+07, -4.55624687e+04, 74.9544363, -7.84541558e-03, 1.444393314e-06,
|
||
|
-1.464370213e-10, 6.230285e-15, 2.544927135e+05, -480.198578]
|
||
|
note: 2-Methylbutane. TRC(10/85) tuvw1350. [n10/85]
|
||
|
- name: CH3C(CH3)2CH3
|
||
|
composition: {C: 5, H: 12}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-8.97322227e+06, 1.289225617e+05, -719.934483, 2.056862183, -2.953159699e-03,
|
||
|
2.158893146e-06, -6.26831877e-10, -6.39493202e+05, 4020.80636]
|
||
|
- [1.68470552e+07, -5.97943057e+04, 86.8545148, -9.6219176e-03, 1.653363091e-06,
|
||
|
-1.674727926e-10, 7.37211936e-15, 3.45849682e+05, -576.046697]
|
||
|
note: 2,2-Dimethylpropane (neopentane). TRC(10/85) tuvw1350. [n10/85]
|
||
|
- name: C6H2
|
||
|
composition: {C: 6, H: 2}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [2.903722964e+05, -4929.7515, 31.8932321, -0.03119447315, 4.32576368e-05,
|
||
|
-2.732517022e-08, 6.67444611e-12, 1.011898682e+05, -153.0593012]
|
||
|
- [2.592848577e+06, -1.083361978e+04, 28.47459495, -1.876727704e-03,
|
||
|
3.41213428e-07, -3.33739289e-11, 1.356853889e-15, 1.418517294e+05,
|
||
|
-149.4853494]
|
||
|
note: Dorofeeva,1991. [g 2/93]
|
||
|
- name: C6H5,phenyl
|
||
|
composition: {C: 6, H: 5}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.211278245e+05, 3529.04558, -31.16903422, 0.146755063, -1.831398296e-04,
|
||
|
1.192576957e-07, -3.14926586e-11, 2.420972928e+04, 186.8799946]
|
||
|
- [3.67027923e+06, -1.894601209e+04, 41.8058182, -3.50391415e-03, 6.56182174e-07,
|
||
|
-6.59471445e-11, 2.748094212e-15, 1.476744628e+05, -247.5301142]
|
||
|
note: Radical.Hf:TRC(10/89) w4270. Jacox,1998. NASA ab initio. [g11/00]
|
||
|
- name: C6H5O,phenoxy
|
||
|
composition: {C: 6, H: 5, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.292264217e+05, 3406.74068, -29.11367361, 0.1459180378, -1.780202758e-04,
|
||
|
1.138615885e-07, -2.967142152e-11, -1.055026758e+04, 177.0682011]
|
||
|
- [3.67864034e+06, -1.972980806e+04, 45.4118441, -3.75106439e-03, 7.11445078e-07,
|
||
|
-7.23332885e-11, 3.045637067e-15, 1.163595961e+05, -268.1058539]
|
||
|
note: Phenoxy radical. Burcat,1985. [g 8/00]
|
||
|
- name: C6H6
|
||
|
composition: {C: 6, H: 6}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.677340902e+05, 4404.50004, -37.1737791, 0.1640509559, -2.020812374e-04,
|
||
|
1.307915264e-07, -3.4442841e-11, -1.035455401e+04, 216.9853345]
|
||
|
- [4.53857572e+06, -2.260502547e+04, 46.940073, -4.20667683e-03, 7.90799433e-07,
|
||
|
-7.9683021e-11, 3.32821208e-15, 1.391464686e+05, -286.8751333]
|
||
|
note: TRC(10/86)w3200. Pliva,1982,1983,1984. Shimanouchi,1972. [g 8/00]
|
||
|
- name: C6H5OH,phenol
|
||
|
composition: {C: 6, H: 6, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.209418144e+05, 3378.29227, -29.91846148, 0.1567802942, -1.970937198e-04,
|
||
|
1.291815064e-07, -3.42435126e-11, -2.779387017e+04, 179.9708977]
|
||
|
- [4.46208157e+06, -2.165521026e+04, 48.1501505, -3.56828243e-03, 6.32717573e-07,
|
||
|
-6.03990572e-11, 2.399168678e-15, 1.113726204e+05, -286.0454446]
|
||
|
note: Burcat,1985. [g 8/00]
|
||
|
- name: C6H10,cyclo-
|
||
|
composition: {C: 6, H: 10}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.75028221e+05, 7643.87675, -55.1043476, 0.2166231405, -2.545452198e-04,
|
||
|
1.607607304e-07, -4.18524841e-11, -3.66107301e+04, 320.240946]
|
||
|
- [7.51012898e+06, -3.55685821e+04, 67.0303494, -7.04535187e-03, 1.3581664e-06,
|
||
|
-1.400074492e-10, 5.9645517e-15, 2.060274332e+05, -423.819766]
|
||
|
note: Cyclohexene. Dorofeeva,1986. [g 1/93]
|
||
|
- name: C6H12,1-hexene
|
||
|
composition: {C: 6, H: 12}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-6.66883165e+05, 1.176864939e+04, -72.7099833, 0.2709398396, -3.3332464e-04,
|
||
|
2.182347097e-07, -5.85946882e-11, -6.21578054e+04, 428.682564]
|
||
|
- [7.33290696e+05, -1.448848641e+04, 46.7121549, 3.17297847e-03, -5.24264652e-07,
|
||
|
4.28035582e-11, -1.472353254e-15, 6.69774041e+04, -262.3643854]
|
||
|
note: TRC(4/87) tuvw2500. [n 4/87]
|
||
|
- name: C6H12,cyclo-
|
||
|
composition: {C: 6, H: 12}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.67998704e+05, 1.034238704e+04, -68.0004125, 0.2387797658, -2.511890049e-04,
|
||
|
1.425293184e-07, -3.40783319e-11, -6.40463516e+04, 393.480821]
|
||
|
- [5.22514947e+06, -3.36419458e+04, 71.7460747, -6.69897912e-03, 1.318443254e-06,
|
||
|
-1.390794789e-10, 6.06010224e-15, 1.732537609e+05, -454.681417]
|
||
|
note: Cyclohexane. Dorofeeva,1986. [g 6/90]
|
||
|
- name: C6H13,n-hexyl
|
||
|
composition: {C: 6, H: 13}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.42727822e+06, 2.248828093e+04, -129.749224, 0.427979733, -5.55601318e-04,
|
||
|
3.79125694e-07, -1.048462404e-10, -1.060261015e+05, 749.718676]
|
||
|
- [5.96793862e+06, -3.29902316e+04, 68.6907344, -4.22500906e-03, 5.49652382e-07,
|
||
|
-2.292851471e-11, -5.08634189e-16, 1.906978683e+05, -418.5362]
|
||
|
note: TRC(10/83) tuvw1930. [n10/83]
|
||
|
- name: C6H14,n-hexane
|
||
|
composition: {C: 6, H: 14}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-5.8159267e+05, 1.079097724e+04, -66.3394703, 0.2523715155, -2.904344705e-04,
|
||
|
1.802201514e-07, -4.61722368e-11, -7.27154457e+04, 393.828354]
|
||
|
- [-3.106625684e+06, -7346.08792, 46.9413176, 1.693963977e-03, 2.068996667e-06,
|
||
|
-4.21214168e-10, 2.452345845e-14, 523.750312, -254.9967718]
|
||
|
note: TRC(4/85) tuvw1440. [g 6/01]
|
||
|
- name: C7H7,benzyl
|
||
|
composition: {C: 7, H: 7}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.836764826e+05, 4102.46566, -32.024061, 0.1588249575, -1.894466924e-04,
|
||
|
1.203649671e-07, -3.136589637e-11, 5266.33323, 193.875172]
|
||
|
- [5.29732216e+06, -2.599909398e+04, 55.0975079, -4.97766147e-03, 9.46315243e-07,
|
||
|
-9.63900886e-11, 4.06447042e-15, 1.738382912e+05, -334.382955]
|
||
|
note: Radical. Brouwer,1988. Hippler,1990. [g 7/01]
|
||
|
- name: C7H8
|
||
|
composition: {C: 7, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.87796222e+05, 6133.94152, -45.7470676, 0.1936895724, -2.304305304e-04,
|
||
|
1.459301178e-07, -3.7907961e-11, -2.308402499e+04, 269.3915042]
|
||
|
- [6.18453835e+06, -2.990284056e+04, 59.8200597, -5.69698396e-03, 1.080748416e-06,
|
||
|
-1.098702235e-10, 4.62474022e-15, 1.782047857e+05, -369.808225]
|
||
|
note: Hf:TRC(4/98) w3510. Hitchcock,1975. Rudolph,1967. [g 1/93]
|
||
|
- name: C7H8O,cresol-mx
|
||
|
composition: {C: 7, H: 8, O: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.441417503e+05, 5080.87784, -37.8904804, 0.186494507, -2.269511868e-04,
|
||
|
1.458989279e-07, -3.82240335e-11, -4.09365783e+04, 228.1352234]
|
||
|
- [6.01737345e+06, -2.849882774e+04, 60.8154307, -4.99680711e-03, 9.13427995e-07,
|
||
|
-8.97944411e-11, 3.66775697e-15, 1.4722184e+05, -367.485014]
|
||
|
note: Eql. mixture of isomers. Kudchadker,1978. [g12/00]
|
||
|
- name: C7H14,1-heptene
|
||
|
composition: {C: 7, H: 14}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.44940284e+05, 1.332179893e+04, -82.8169438, 0.3108065994, -3.78677992e-04,
|
||
|
2.446841042e-07, -6.48876387e-11, -7.21788501e+04, 485.667149]
|
||
|
- [-1.927608174e+06, -9125.02442, 47.4817797, 6.06766053e-03, -8.68485908e-07,
|
||
|
5.81399526e-11, -1.473979569e-15, 2.600914656e+04, -256.2880707]
|
||
|
note: TRC(4/87) tuvw2500. [n 4/87]
|
||
|
- name: C7H15,n-heptyl
|
||
|
composition: {C: 7, H: 15}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.671733521e+06, 2.64001025e+04, -152.6867707, 0.502712141, -6.52101403e-04,
|
||
|
4.44348811e-07, -1.227815006e-10, -1.273754623e+05, 878.393332]
|
||
|
- [5.44452757e+06, -3.45682929e+04, 76.3865195, -3.298972e-03, 2.343496957e-07,
|
||
|
2.467674021e-11, -3.162012849e-15, 1.939079354e+05, -464.142466]
|
||
|
note: TRC(10/83) tuvw1930. [n10/83]
|
||
|
- name: C7H16,n-heptane
|
||
|
composition: {C: 7, H: 16}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-6.12743289e+05, 1.184085437e+04, -74.871886, 0.2918466052, -3.41679549e-04,
|
||
|
2.159285269e-07, -5.65585273e-11, -8.01340894e+04, 440.721332]
|
||
|
- [9.13563247e+06, -3.92331969e+04, 78.8978085, -4.65425193e-03, 2.071774142e-06,
|
||
|
-3.4425393e-10, 1.976834775e-14, 2.050708295e+05, -485.110402]
|
||
|
note: TRC(10/85) tuv1460. TRC(10/84) ptuv1010. [n10/85]
|
||
|
- name: C7H16,2-methylh
|
||
|
composition: {C: 7, H: 16}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-7.10477777e+05, 1.19125112e+04, -73.4533944, 0.2902952369, -3.46276768e-04,
|
||
|
2.260184498e-07, -6.12881392e-11, -8.2021477e+04, 432.004229]
|
||
|
- [1.289912969e+06, -1784.340963, 10.83537673, 0.0527060924, -1.886832314e-05,
|
||
|
2.432255843e-09, -1.135553789e-13, -1.637529884e+04, -29.8186241]
|
||
|
note: 2-methylhexane. TRC(10/85) tuvw1460. [n10/85]
|
||
|
- name: C8H8,styrene
|
||
|
composition: {C: 8, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.68693052e+05, 6167.99947, -48.3605494, 0.2182873229, -2.738561832e-04,
|
||
|
1.810084981e-07, -4.86775027e-11, -1.140639978e+04, 281.7679014]
|
||
|
- [-6.62918362e+06, 1.514594166e+04, 1.609822364, 0.033833186, -1.093737395e-05,
|
||
|
1.338825116e-09, -6.03253492e-14, -8.99732415e+04, 43.1128279]
|
||
|
note: Ethenylbenzene. TRC(4/89) tuvw4490. [n 4/89]
|
||
|
- name: C8H10,ethylbenz
|
||
|
composition: {C: 8, H: 10}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-4.69494e+05, 9307.16836, -65.2176947, 0.2612080237, -3.18175348e-04,
|
||
|
2.051355473e-07, -5.40181735e-11, -4.07387021e+04, 378.090436]
|
||
|
- [5.5515641e+06, -2.831380598e+04, 60.6124072, 1.042112857e-03, -1.327426719e-06,
|
||
|
2.166031743e-10, -1.142545514e-14, 1.642241062e+05, -369.176982]
|
||
|
note: Ethylbenzene. TRC(10/86) tuvw3200. [n10/86]
|
||
|
- name: C8H16,1-octene
|
||
|
composition: {C: 8, H: 16}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-9.28190522e+05, 1.640974476e+04, -101.5939534, 0.374800141, -4.5908294e-04,
|
||
|
2.96533534e-07, -7.84044521e-11, -8.95242608e+04, 590.759427]
|
||
|
- [-4.40933607e+06, -4383.6788, 49.3915426, 7.91233963e-03, -7.88866951e-07,
|
||
|
9.97021235e-12, 1.913144872e-15, -1.122619342e+04, -257.7650649]
|
||
|
note: TRC(4/87) tuvw2500. [n 4/87]
|
||
|
- name: C8H17,n-octyl
|
||
|
composition: {C: 8, H: 17}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.934340995e+06, 3.05497983e+04, -176.7903454, 0.580159665, -7.51741401e-04,
|
||
|
5.11246903e-07, -1.410193662e-10, -1.498894706e+05, 1013.724329]
|
||
|
- [5.63217339e+06, -3.82114367e+04, 86.379275, -3.60893158e-03, 2.544260445e-07,
|
||
|
2.908638837e-11, -3.67954974e-15, 2.10313547e+05, -526.242283]
|
||
|
note: TRC(10/83) tuvw1930. [n10/83]
|
||
|
- name: C8H18,n-octane
|
||
|
composition: {C: 8, H: 18}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-6.98664715e+05, 1.338501096e+04, -84.1516592, 0.327193666, -3.77720959e-04,
|
||
|
2.339836988e-07, -6.01089265e-11, -9.02622325e+04, 493.922214]
|
||
|
- [6.36540695e+06, -3.105364657e+04, 69.6916234, 0.01048059637, -4.12962195e-06,
|
||
|
5.54322632e-10, -2.651436499e-14, 1.500968785e+05, -416.989565]
|
||
|
note: TRC(4/85) tuvw1490. [n 4/85]
|
||
|
- name: C8H18,isooctane
|
||
|
composition: {C: 8, H: 18}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-1.688758565e+05, 3126.903227, -21.23502828, 0.1489151508, -1.151180135e-04,
|
||
|
4.47321617e-08, -5.55488207e-12, -4.46806062e+04, 141.7455793]
|
||
|
- [1.352765032e+07, -4.66337034e+04, 77.9531318, 0.01423729984, -5.07359391e-06,
|
||
|
7.24823297e-10, -3.81919011e-14, 2.541178017e+05, -493.388719]
|
||
|
note: 2,2,4-Trimethylpentane. TRC(4/85) tuvw1490. [n 4/85]
|
||
|
- name: C9H19,n-nonyl
|
||
|
composition: {C: 9, H: 19}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.194880612e+06, 3.46856578e+04, -200.9261419, 0.658050311, -8.52593001e-04,
|
||
|
5.79463896e-07, -1.597637099e-10, -1.723194608e+05, 1149.114017]
|
||
|
- [5.27736174e+06, -4.02570196e+04, 94.5729672, -2.940301447e-03, 6.97810699e-09,
|
||
|
6.80525024e-11, -5.90709533e-15, 2.165320614e+05, -575.44495]
|
||
|
note: TRC (10/83) tuvw1930. [n10/83]
|
||
|
- name: C10H8,naphthale
|
||
|
composition: {C: 10, H: 8}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.602845316e+05, 6237.40957, -52.2609504, 0.2397692776, -2.912244803e-04,
|
||
|
1.854944401e-07, -4.81661927e-11, -1.11470088e+04, 297.2139517]
|
||
|
- [5.90617211e+06, -3.16322924e+04, 70.3034203, -6.01886554e-03, 1.142052144e-06,
|
||
|
-1.161605689e-10, 4.89284402e-15, 1.962567046e+05, -434.784895]
|
||
|
note: Naphthalene. Chen,1979. [g 3/01]
|
||
|
- name: C10H21,n-decyl
|
||
|
composition: {C: 10, H: 21}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-2.446511152e+06, 3.8700813e+04, -224.4388176, 0.734362497, -9.5135256e-04,
|
||
|
6.46297033e-07, -1.781502862e-10, -1.941633889e+05, 1280.987834]
|
||
|
- [4.96723776e+06, -4.24246844e+04, 102.8853417, -2.32484818e-03, -2.2842339e-07,
|
||
|
1.056127364e-10, -8.0680659e-15, 2.23542989e+05, -625.519116]
|
||
|
note: TRC(10/83) tuvw1930. [n10/83]
|
||
|
- name: C11H21
|
||
|
composition: {C: 11, H: 21}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [300.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [5.31692016e+12, -5.88423439e+10, 2.609160494e+08, -5.9489246e+05,
|
||
|
737.326571, -0.472114411, 1.222918263e-04, 2.961278874e+11, -1.505521387e+09]
|
||
|
- [-1.119286953e+12, 2.697388673e+09, -2.513061451e+06, 1202.853628,
|
||
|
-0.3016858875, 3.78204471e-05, -1.876493145e-09, -1.773150994e+10,
|
||
|
1.84122365e+07]
|
||
|
note: FROM CHRIS SNYDER [G12/12]
|
||
|
- name: C12H9,o-bipheny
|
||
|
composition: {C: 12, H: 9}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.59584082e+05, 7661.37856, -58.7329046, 0.2697557882, -3.22975668e-04,
|
||
|
2.0329071e-07, -5.23131672e-11, 1.458414642e+04, 339.268711]
|
||
|
- [6.73646942e+06, -3.63219435e+04, 82.102396, -7.50234286e-03, 1.456251733e-06,
|
||
|
-1.507145019e-10, 6.43647043e-15, 2.555524521e+05, -504.246297]
|
||
|
note: o-Biphenyl radical. Burcat,1985. [g 8/00]
|
||
|
- name: C12H10,biphenyl
|
||
|
composition: {C: 12, H: 10}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0]
|
||
|
data:
|
||
|
- [-3.67103405e+05, 8128.41259, -63.9099457, 0.2901422744, -3.50959074e-04,
|
||
|
2.230989996e-07, -5.78847029e-11, -1.679263066e+04, 363.346419]
|
||
|
- [7.48038536e+06, -3.92808723e+04, 86.6148222, -7.94639857e-03, 1.531868544e-06,
|
||
|
-1.576450171e-10, 6.70060273e-15, 2.438050641e+05, -538.138149]
|
||
|
note: Burcat,1985. [g 8/00]
|
||
|
- name: CL
|
||
|
composition: {Cl: 1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [200.0, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [2.276215854e+04, -216.8413293, 2.745185115, 2.451101694e-03, -5.45801199e-06,
|
||
|
4.41798688e-09, -1.288134004e-12, 1.501357068e+04, 3.102963457]
|
||
|
- [-1.69793293e+05, 608.172646, 2.12866409, 1.307367034e-04, -2.644883596e-08,
|
||
|
2.842504775e-12, -1.252911731e-16, 9934.3874, 8.844772103]
|
||
|
- [-7.13968707e+07, 4.49993633e+04, -9.26431535, 1.657437964e-03, -1.326219399e-07,
|
||
|
5.53399887e-12, -8.390301878e-17, -3.40533303e+05, 106.9111426]
|
||
|
note: Hf:Cox,1989. Moore,1971. Moore,1970a. Gordon,1999. [g 7/97]
|
||
|
- name: CL+
|
||
|
composition: {Cl: 1, E: -1}
|
||
|
thermo:
|
||
|
model: NASA9
|
||
|
temperature-ranges: [298.15, 1000.0, 6000.0, 2.0e+04]
|
||
|
data:
|
||
|
- [1.034697859e+05, -1293.758873, 8.18670269, -9.9160146e-03, 9.20847237e-06,
|
||
|
-4.50742624e-09, 9.18212788e-13, 1.71475878e+05, -27.66417931]
|
||
|
- [4.05640948e+04, -49.6016572, 3.10165363, -5.86873829e-04, 2.252039316e-07,
|
||
|
-3.29970302e-11, 1.708780842e-15, 1.652982337e+05, 2.574942598]
|
||
|
- [-3.078099946e+06, -685.841828, 3.092289282, -1.922260015e-05, 3.80555156e-10,
|
||
|
-1.571848967e-13, 8.44251388e-18, 1.683434405e+05, 1.334407234]
|
||
|
note: Moore,1971. Moore,1970a. Gordon,1999. [g 1/98]
|