ACCURATE EFFECTIVE CORE POTENTIAL FOR GERMANIUM - APPLICATION TO THE SINGLET TRIPLET SPLITTING IN GEH2

被引：28

作者：

PETTERSSON, LGM

SIEGBAHN, PEM

机构：

[1] IBM CORP,RES LAB,SAN JOSE,CA 95193

[2] UNIV STOCKHOLM,INST THEORET PHYS,S-11346 STOCKHOLM,SWEDEN

来源：

CHEMICAL PHYSICS | 1986年 / 105卷 / 03期

关键词：

D O I：

10.1016/0301-0104(86)80123-9

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：

引用

页码：355 / 360

页数：6

共 22 条

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[6] IMPROVED ABINITIO EFFECTIVE CORE POTENTIALS FOR MOLECULAR CALCULATIONS
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[8] Davidson E.R., 1974, WORLD QUANTUM CHEM
[9] ABINITIO EFFECTIVE CORE POTENTIALS FOR MOLECULAR CALCULATIONS .2. ALL-ELECTRON COMPARISONS AND MODIFICATIONS OF PROCEDURE
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1978, 68 (07) : 3059 - 3066
[10] GAUSSIAN-TYPE FUNCTIONS FOR POLYATOMIC SYSTEMS .I.
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