USE OF METHOD OF DIATOMICS-IN-MOLECULES IN FITTING AB-INITIO POTENTIAL SURFACES - SYSTEM HEH2+

被引：112

作者：

KUNTZ, PJ

机构：

来源：

CHEMICAL PHYSICS LETTERS | 1972年 / 16卷 / 03期

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D O I：

10.1016/0009-2614(72)80429-9

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：

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页码：581 / &

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[1] Bates D., 1968, ADV AT MOL PHYS, V4, P13
[2] QUANTUM MECHANICAL INVESTIGATION OF HEH3+ ENERGY SURFACE
BENSON, MJ
MCLAUGHL.DR
[J]. JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (03) : 1322 - &
[3] NONEMPIRICAL LCAO-MO-SCF STUDY OF ENERGY SURFACE FOR LINEAR HEH2+
BROWN, PJ
HAYES, EF
[J]. JOURNAL OF CHEMICAL PHYSICS, 1971, 55 (02) : 922 - &
[4] THEORETICAL STUDY OF INTERACTION POTENTIAL AND HYPERFINE PRESSURE SHIFTS IN HEH
DAS, G
RAY, S
[J]. PHYSICAL REVIEW LETTERS, 1970, 24 (25) : 1391 - &
[5] HYDROGEN BONDING OF H2+ TO HE ATOM - ENERGY SURFACE FOR LINEAR HEH2+
EDMISTON, C
DOOLITTLE, J
MURPHY, K
TANG, KC
WILLSON, W
[J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (07) : 3419 - +
[6] A METHOD OF DIATOMICS IN MOLECULES .1. GENERAL THEORY AND APPLICATION TO H2O
ELLISON, FO
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1963, 85 (22) : 3540 - &
[7] CALCULATION OF HE-H INTERACTION ENERGY
FISCHER, CR
KEMMEY, PJ
[J]. JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (01) : 50 - &
[8] ION-MOLECULE REACTIONS OF RARE-GASES WITH HYDROGEN .1. DIATOMICS-IN-MOLECULES POTENTIAL-ENERGY SURFACE FOR ARH+2
KUNTZ, PJ
ROACH, AC
[J]. JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS II, 1972, 68 (02): : 259 - &
[9] KUNTZ PJ, IN PRESS
[10] LOCATION OF ENERGY BARRIERS .I. EFFECT ON DYNAMICS OF REACTIONS A+BC
POLANYI, JC
WONG, WH
[J]. JOURNAL OF CHEMICAL PHYSICS, 1969, 51 (04) : 1439 - &