SPIN-COUPLED VB DESCRIPTION OF THE POTENTIAL-ENERGY SURFACES FOR THE REACTION BE+ +H-2-]BEH+ +H

被引：14

作者：

RAIMONDI, M ^{[1
]}

GERRATT, J ^{[1
]}

机构：

[1] UNIV BRISTOL,DEPT THEORET CHEM,BRISTOL BS8 1TH,AVON,ENGLAND

来源：

JOURNAL OF CHEMICAL PHYSICS | 1983年 / 79卷 / 09期

关键词：

D O I：

10.1063/1.446315

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：4339 / 4345

页数：7

共 33 条

[1] ACCURATE AB-INITIO CALCULATION OF BEH MOLECULE .1. X 2SIGMA+ AND A 2PI STATES [J].

BAGUS, PS ;

MOSER, CM ;

GOETHALS, P ;

VERHAEGEN, G .

JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (05) :1886-1897

[2] LOW-LYING ELECTRONIC STATES OF MAGNESIUM HYDRIDE [J].

BALFOUR, WJ ;

CARTWRIGHT, HM .

CHEMICAL PHYSICS LETTERS, 1975, 32 (01) :82-85

[3] HIGH-RESOLUTION EMISSION-SPECTRA OF MGH AND MGD IN 600 TO 850 NM WAVELENGTH REGION [J].

BALFOUR, WJ ;

LINDGREN, B .

CANADIAN JOURNAL OF PHYSICS, 1978, 56 (06) :767-779

[4] B'2SIGMA+ -]SIGMAX2SIGMA+ SYSTEMS OF MGH AND MGD [J].

BALFOUR, WJ ;

CARTWRIGHT, HM .

CANADIAN JOURNAL OF PHYSICS, 1976, 54 (18) :1898-1904

[5] ROTATIONAL ANALYSIS AND DEPERTURBATION OF THE C2-SIGMA+-X2-SIGMA+ BAND SYSTEMS OF BEH AND BED [J].

COLIN, R ;

DREZE, C ;

STEINHAUER, M .

CANADIAN JOURNAL OF PHYSICS, 1983, 61 (04) :641-655

[6] THE SPIN-COUPLED VALENCE BOND THEORY OF MOLECULAR ELECTRONIC-STRUCTURE .1. BASIC THEORY AND APPLICATION TO THE 2-SIGMA + STATES OF BEH [J].

GERRATT, J ;

RAIMONDI, M .

PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES, 1980, 371 (1747) :525-552

[7]

GERRATT J, UNPUB J CHEM PHYS

[8]

GERRATT J, 1971, ATOMIC MOLECULAR PHY, V7, P141

[9]

GERRATT J, UNPUB

[10] IMPROVED QUANTUM THEORY OF MANY-ELECTRON SYSTEMS .2. BASIC METHOD [J].

GODDARD, WA .

PHYSICAL REVIEW, 1967, 157 (01) :81-&

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