INCLUSION OF HYDROGEN-P ORBITALS IN THE SEMI-EMPIRICAL CALCULATION OF NMR PARAMETERS .1. INFLUENCE ON THE FPT INDO SPIN-SPIN COUPLING-CONSTANTS

被引：9

作者：

FACELLI, JC

CONTRERAS, RH

机构：

来源：

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | 1980年 / 18卷 / 05期

关键词：

D O I：

10.1002/qua.560180506

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：1175 / 1185

页数：11

共 35 条

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