ISOTROPIC COUPLING-CONSTANT FOR THE NITROGEN ATOM FROM CORRELATED CALCULATIONS BASED ON SPIN-UNRESTRICTED WAVE-FUNCTIONS

被引：10

作者：

CARMICHAEL, I

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1990年 / 93卷 / 01期

关键词：

D O I：

10.1063/1.459459

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：863 / 864

页数：2

共 15 条

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[3] ISOTROPIC COUPLING-CONSTANTS FOR THE ATOMS B-F FROM CORRELATED CALCULATIONS BASED ON SPIN-UNRESTRICTED WAVE-FUNCTIONS [J].

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[8] CALCULATION OF HYPERFINE COUPLING-CONSTANTS - AN ABINITIO MRD CI STUDY FOR NITROGEN TO ANALYZE THE EFFECTS OF BASIS-SETS AND CI PARAMETERS [J].

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[10]

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