DYNAMICAL STUDY OF NON-ADIABATIC UNIMOLECULAR REACTIONS - THE CONICAL INTERSECTION BETWEEN THE B2B2 AND A2A1 STATES OF H2O+

被引：79

作者：

DEHARENG, D ^{[1
]}

CHAPUISAT, X ^{[1
]}

LORQUET, JC ^{[1
]}

GALLOY, C ^{[1
]}

RASEEV, G ^{[1
]}

机构：

[1] UNIV PARIS 11,CNRS,ERA 549,CHIM THEORIQUE LAB,F-91405 ORSAY,FRANCE

来源：

JOURNAL OF CHEMICAL PHYSICS | 1983年 / 78卷 / 03期

关键词：

D O I：

10.1063/1.444862

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

收藏

页码：1246 / 1264

页数：19

相关论文

共 70 条

[51] MOLECULAR TRAJECTORY CALCULATIONS
PORTER, RN
[J]. ANNUAL REVIEW OF PHYSICAL CHEMISTRY, 1974, 25 : 317 - 355
[52] PRENTER PM, 1975, SPLINES VARIATIONAL
[53] EFFECTS OF SURFACE CROSSING IN CHEMICAL REACTIONS - H3+ SYSTEM
PRESTON, RK
TULLY, JC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 54 (10) : 4297 - &
[54] THEORETICAL PREDICTION OF VIBRATIONAL ENHANCEMENT FOR DISSOCIATIVE CHARGE-TRANSFER IN HEH2+ SYSTEM
PRESTON, RK
THOMPSON, DL
MCLAUGHLIN, DR
[J]. JOURNAL OF CHEMICAL PHYSICS, 1978, 68 (01) : 13 - 21
[55] ROUSE RA, 1976, J CHEM PHYS, V64, P1224
[56] AVOIDED SURFACE CROSSINGS
SALEM, L
LEFORESTIER, C
SEGAL, G
WETMORE, R
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (03) : 479 - 487
[57] SANNEN C, 1981, J CHEM PHYS, V74, P2402, DOI 10.1063/1.441361
[58] DIABATIC AND ADIABATIC REPRESENTATIONS FOR ATOMIC COLLISION PROBLEMS
SMITH, FT
[J]. PHYSICAL REVIEW, 1969, 179 (01): : 111 - &
[59] LIMITED BASIS MOLECULAR-ORBITAL CALCULATION ON H2O AND H2O+
SMITH, JA
JORGENSEN, P
OHRN, Y
[J]. JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (04) : 1285 - 1288
[60] INCORPORATION OF ELECTRONICALLY NONADIABATIC EFFECTS INTO BIMOLECULAR REACTIVE SYSTEMS .2. COLLINEAR (H2+H+,H2+H) SYSTEM
TOP, ZH
BAER, M
[J]. CHEMICAL PHYSICS, 1977, 25 (01) : 1 - 18

← 1 2 3 4 5 6 7 →