STUDY OF MOLECULAR PAIR POTENTIALS - SEMIEMPIRICAL APPROACH

被引：3

作者：

ELLIS, RL ^{[1
]}

机构：

[1] UNIV ILLINOIS,DEPT CHEM,URBANA,IL 61801

来源：

JOURNAL OF CHEMICAL PHYSICS | 1976年 / 64卷 / 01期

关键词：

D O I：

10.1063/1.431927

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：342 / 348

页数：7

共 22 条

[1] NE-H-H POTENTIAL-ENERGY SURFACE INCLUDING ELECTRON CORRELATION [J].

BIRKS, JW ;

JOHNSTON, HS ;

SCHAEFER, HF .

JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (05) :1741-1747

[2] MODIFIED STATISTICAL METHOD FOR INTERMOLECULAR POTENTIALS COMBINING RULES FOR HIGHER VANDERWAALS COEFFICIENTS [J].

COHEN, JS ;

PACK, RT .

JOURNAL OF CHEMICAL PHYSICS, 1974, 61 (06) :2372-2382

[3]

Dalgarno A., 1967, ADV CHEM PHYS, V12, P143

[4]

DELBENE J, 1968, J CHEM PHYS, V48, P1807

[5]

ELLIS RL, UNPUBLISHED WORK

[6] HELIUM-ATOM-HYDROGEN-MOLECULE POTENTIAL SURFACE EMPLOYING LCAO-MO-SCF AND CI METHODS [J].

GORDON, MD ;

SECREST, D .

JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (01) :120-&

[7] THEORY FOR FORCES BETWEEN CLOSED-SHELL ATOMS AND MOLECULES [J].

GORDON, RG ;

KIM, YS .

JOURNAL OF CHEMICAL PHYSICS, 1972, 56 (06) :3122-&

[8] VAN DER WAALS FORCES IN ATOMS AND MOLECULES [J].

KARPLUS, M ;

KOLKER, HJ .

JOURNAL OF CHEMICAL PHYSICS, 1964, 41 (12) :3955-&

[9] THEORY OF HYDROGEN-BOND [J].

KOLLMAN, PA ;

ALLEN, LC .

CHEMICAL REVIEWS, 1972, 72 (03) :283-&

[10]

MARGENAU H, 1969, THEORY INTERMOLECULA, pCH2

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