THE NUCLEAR-QUADRUPOLE MOMENT OF LI - REFINED CALCULATIONS OF ELECTRIC-FIELD GRADIENTS IN LIH, LIF, AND LICL

被引：33

作者：

URBAN, M ^{[1
]}

SADLEJ, AJ ^{[1
]}

机构：

[1] UNIV LUND,CTR CHEM,S-22100 LUND,SWEDEN

来源：

CHEMICAL PHYSICS LETTERS | 1990年 / 173卷 / 2-3期

关键词：

D O I：

10.1016/0009-2614(90)80070-T

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：

A series of high-level correlated calculations of the electric field gradient at the Li nucleus have been performed for LiH, LiF, and LiCl. The present results lead to a refined "molecular" value of the nuclear quadrupole moment of 7Li, Q(7Li)=-4.01 e fm2 which is an excellent agreement with the most recent result (-4.03±0.06 e fm2) derived from the nuclear scattering data. © 1990.

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页码：157 / 163

页数：7

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