Density Functional Theory: Not Quite the Right Answer for the Right Reason Yet

被引：41

作者：

Korth, Martin ^{[1
]}

机构：

[1] Ulm Univ, Inst Theoret Chem, Albert Einstein Allee 11, D-89069 Ulm, Germany

来源：

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION | 2017年 / 56卷 / 20期

关键词：

density functional theory; empirical parametrization; error analysis; functional development; physical insight; HELLMANN-FEYNMAN; EXCHANGE; MATRICES;

D O I：

10.1002/anie.201701894

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

[No abstract available]

引用

页码：5396 / 5398

页数：3

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