AB-INITIO CALCULATIONS ON LARGE MOLECULES USING MOLECULAR FRAGMENTS - UNRESTRICTED HARTREE-FOCK CALCULATIONS ON LOW-LYING STATES OF FORMALDEHYDE AND ITS RADICAL IONS

被引：19

作者：

DAVIS, TD

MAGGIORA, GM

CHRISTOFFERSEN, RE

机构：

[1] UNIV KANSAS,DEPT BIOCHEM,LAWRENCE,KS 66045

[2] UNIV KANSAS,DEPT CHEM,LAWRENCE,KS 66045

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1974年 / 96卷 / 26期

关键词：

D O I：

10.1021/ja00833a007

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

收藏

页码：7878 / 7887

页数：10

相关论文

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[10] AB-INITIO CALCULATIONS ON LARGE MOLECULES USING MOLECULAR FRAGMENTS - INITIAL STUDIES ON OPEN-SHELL SYSTEMS
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