STATIONARY RESPONSE WITH EXPONENTIAL TRANSFORMATION - A PERTURBATIVE ANALYSIS FOR MOLECULAR STATIC PROPERTIES

被引：5

作者：

GHOSE, KB

机构：

[1] Physical Chemistry Division, National Chemical Laboratory, Poona

来源：

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | 1995年 / 53卷 / 03期

关键词：

D O I：

10.1002/qua.560530304

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：

We present here a perturbative analysis of the coupled cluster response method for molecular static properties with Euler and extended coupled cluster functionals under cubic truncation. Comparative analysis is meant to cater to both pedagogical and practical interests. Comprehensive tables for energy-derivative expressions and equations at the stationary point are presented. (C) John Wiley & Sons, Inc.

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页码：275 / 286

页数：12

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