HOW MUCH DO MULTIPLE ELECTRONIC SURFACES INFLUENCE CHEMICAL REACTIVITY - F+H2 - CASE-STUDY

被引：22

作者：

KOMORNICKI, A ^{[1
]}

GEORGE, TF ^{[1
]}

MOROKUMA, K ^{[1
]}

机构：

[1] UNIV ROCHESTER,DEPT CHEM,ROCHESTER,NY 14627

来源：

JOURNAL OF CHEMICAL PHYSICS | 1976年 / 65卷 / 10期

关键词：

D O I：

10.1063/1.432840

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

页码：4312 / 4314

页数：3

共 36 条

[1] F+H2, D2, HD REACTIONS - CHEMICAL LASER DETERMINATION OF PRODUCT VIBRATIONAL-STATE POPULATIONS AND F+HD INTRAMOLECULAR KINETIC ISOTOPE-EFFECT
BERRY, MJ
[J]. JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (12) : 6229 - 6253
[2] MONTE-CARLO TRAJECTORIES - DYNAMICS OF REACTION F+D2 ON A SEMIEMPIRICAL VALENCE-BOND POTENTIAL-ENERGY SURFACE
BLAIS, NC
TRUHLAR, DG
[J]. JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (03) : 1090 - 1108
[3] EXACT QUANTUM TRANSITION-PROBABILITIES BY STATE PATH SUM METHOD - COLLINEAR F+H2 REACTION
CONNOR, JNL
JAKUBETZ, W
MANZ, J
[J]. MOLECULAR PHYSICS, 1975, 29 (02) : 347 - 355
[4] TEMPERATURE-DEPENDENCE OF VIBRATIONAL ENERGY-DISTRIBUTIONS IN REACTIONS F + H2 AND F + D2
COOMBE, RD
PIMENTEL, GC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (01) : 251 - 257
[5] EFFECTS OF ROTATION ON VIBRATIONAL ENERGY-DISTRIBUTIONS IN REACTION F+H2
COOMBE, RD
PIMENTEL, GC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (03) : 1535 - 1536
[6] COOMBE RD, 1973, J CHEM PHYS, V59, P6229
[7] HYDROGEN ABSTRACTION REACTIONS BY ATOMIC FLUORINE .3. TEMPERATURE-DEPENDENCE OF INTERMOLECULAR KINETIC ISOTOPE-EFFECT FOR THERMAL F AND H2 REACTION
GRANT, ER
ROOT, JW
[J]. JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (07) : 2970 - 2979
[8] HERZBERG G, 1966, MOLECULAR SPECTRA MO, P276
[9] CLASSICAL TRAJECTORY ANALYSIS OF REACTION F+H2-]HF+H
JAFFE, RL
ANDERSON, JB
[J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (05) : 2224 - &
[10] VARIATIONAL THEORY OF REACTION-RATES - APPLICATION TO F+H2REVERSIBLEHF+H
JAFFE, RL
HENRY, JM
ANDERSON, JB
[J]. JOURNAL OF CHEMICAL PHYSICS, 1973, 59 (03) : 1128 - 1141

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