AN IMPROVED POTENTIAL-ENERGY SURFACE FOR F+H2-]HF+H AND H+H'F-]HF+H'

被引：111

作者：

BROWN, FB ^{[1
]}

STECKLER, R ^{[1
]}

SCHWENKE, DW ^{[1
]}

TRUHLAR, DG ^{[1
]}

GARRETT, BC ^{[1
]}

机构：

[1] CHEM DYNAM CORP, COLUMBUS, OH 43220 USA

来源：

关键词：

D O I：

10.1063/1.448781

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：188 / 201

页数：14

共 76 条

[1] QUANTUM-MECHANICAL TREATMENT OF THE F + D2-]DF + D REACTION
ABUSALBI, N
SHOEMAKER, CL
KOURI, DJ
JELLINEK, J
BAER, M
[J]. JOURNAL OF CHEMICAL PHYSICS, 1984, 80 (07) : 3210 - 3222
[2] AHLRICHS R, 1975, J CHEM PHYS, V63, P4685, DOI 10.1063/1.431254
[3] ANDERSON JB, 1980, ADV CHEM PHYS, V41, P229
[4] ASHTON CJ, UNPUB J CHEM PHYS
[5] QUANTUM-MECHANICAL TREATMENT OF THE F+H2-]HF+H REACTION
BAER, M
JELLINEK, J
KOURI, DJ
[J]. JOURNAL OF CHEMICAL PHYSICS, 1983, 78 (06) : 2962 - 2977
[6] QUANTUM-MECHANICAL TREATMENT OF ELECTRONIC-TRANSITIONS IN ATOM-DIATOM EXCHANGE COLLISIONS
BAER, M
[J]. BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1982, 86 (05): : 448 - 458
[7] BAER M, 1981, POTENTIAL ENERGY SUR, P519
[8] BAER M, 1983, MOL COLLISION DYNAMI, P117
[9] EFFECT OF CHANGING REAGENT ENERGY .10. VIBRATIONAL THRESHOLD ENERGIES FOR ALTERNATIVE REACTION PATHS HF(V)+D-]F+HD AND -]H+DF
BARTOSZEK, FE
MANOS, DM
POLANYI, JC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1978, 69 (02) : 933 - 935
[10] EVALUATED KINETIC AND PHOTOCHEMICAL DATA FOR ATMOSPHERIC CHEMISTRY .1. CODATA TASK GROUP ON CHEMICAL-KINETICS
BAULCH, DL
COX, RA
CRUTZEN, PJ
HAMPSON, RF
KERR, JA
TROE, J
WATSON, RT
[J]. JOURNAL OF PHYSICAL AND CHEMICAL REFERENCE DATA, 1982, 11 (02) : 327 - 496