|
469 | 469 |
|
470 | 470 | entry( |
471 | 471 | index=46, |
472 | | - label="H2 + O2 + O2 => HO2 + HO2", |
473 | | - reversible = False, |
474 | | - kinetics=Arrhenius(A=(2e+17, 'cm^6/(mol^2*s)'), n=0, Ea=(25830, 'cal/mol'), T0=(1, 'K')), |
475 | | - shortDesc=u"""[Konnov2015]""", |
476 | | - longDesc=u"""Table 2, Reaction X3""", |
477 | | -) |
478 | | - |
479 | | -entry( |
480 | | - index=47, |
481 | 472 | label="O + OH <=> HO2", |
482 | 473 | kinetics=ThirdBody( |
483 | 474 | arrheniusLow=Arrhenius(A=(1e+15, 'cm^6/(mol^2*s)'), n=0, Ea=(0, 'cal/mol'), T0=(1, 'K'))), |
|
486 | 477 | ) |
487 | 478 |
|
488 | 479 | entry( |
489 | | - index=48, |
| 480 | + index=47, |
490 | 481 | label="HO2 + H <=> H2O2", |
491 | 482 | kinetics=ThirdBody( |
492 | 483 | arrheniusLow=Arrhenius(A=(6.0E+14, 'cm^6/(mol^2*s)'), n=1.25, Ea=(-270, 'cal/mol'), T0=(1, 'K'))), |
|
502 | 493 | ) |
503 | 494 |
|
504 | 495 | entry( |
505 | | - index=49, |
| 496 | + index=48, |
506 | 497 | label="H2O2 + O <=> H2O + O2", |
507 | 498 | kinetics=Arrhenius(A=(8.43E+11, 'cm^3/(mol*s)'), n=0.00, Ea=(3.970E+03, 'cal/mol'), T0=(1, 'K')), |
508 | 499 | shortDesc=u"""[Baulch2005]""", |
509 | 500 | longDesc=u"""Added from the BurkeH2O2 library Reaction X5 in Burke at el. (Table III), Upper limit""", |
510 | 501 | ) |
511 | 502 |
|
512 | 503 | entry( |
513 | | - index=50, |
| 504 | + index=49, |
514 | 505 | label="HO2 + HO2 <=> O2 + OH + OH", |
515 | 506 | kinetics=Arrhenius(A=(6.41E17, 'cm^3/(mol*s)'), n=-1.54, Ea=(16971, 'cal/mol'), Tmin=(400, 'K'), Tmax=(2000, 'K')), |
516 | 507 | shortDesc=u"""[Klippenstein2022]""", |
|
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