ALL-VALENCE-ELECTRON CI CALCULATIONS ON ELECTRONIC-SPECTRUM OF DIBORANE

被引：18

作者：

ELBERT, ST ^{[1
]}

PEYERIMHOFF, SD ^{[1
]}

BUENKER, RJ ^{[1
]}

机构：

[1] UNIV BONN, LEHRSTUHL THEORET CHEM, WEGELER STR 12, 53 BONN, GERMANY

来源：

CHEMICAL PHYSICS | 1975年 / 11卷 / 01期

关键词：

D O I：

10.1016/0301-0104(75)80035-8

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：25 / 40

页数：16

共 33 条

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[3] AB-INITIO CALCULATIONS ON ELECTRONIC-SPECTRUM OF ETHANE
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[6] GEOMETRY OF MOLECULES .2. DIBORANE AND ETHANE
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[7] CALCULATIONS ON ELECTRONIC-SPECTRUM OF WATER
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[8] THEORETICAL-STUDY OF VERTICAL ELECTRONIC-SPECTRUM OF O2 - MIXING OF VALENCE AND RYDBERG STATES
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[J]. CHEMICAL PHYSICS, 1975, 8 (03) : 324 - 337
[9] ONE-BODY GREENS FUNCTION FOR ATOMS AND MOLECULES - THEORY AND APPLICATION
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[J]. JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1975, 8 (02) : 290 - 303
[10] SELECTION OF PROPER CANONICAL ROOTHAAN-HARTREE-FOCK ORBITALS FOR PARTICULAR APPLICATIONS .1. THEORY
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