THEORETICAL-STUDY OF STRUCTURE AND BASICITY OF SOME ALKALI-METAL OXIDES, HYDROXIDES, AND AMIDES

被引：13

作者：

BURK, P

KOPPEL, I

机构：

[1] Institute of Chemical Physics, Tartu University, Tartu

来源：

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | 1994年 / 51卷 / 05期

关键词：

D O I：

10.1002/qua.560510507

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：

Ab initio (TZV*, SBK*, and 3-21G* or 6-31G* basis sets) calculations were Performed to predict the geometries and gas-phase proton affinities of Li2O, LiOH, LiNH2, Na2O, NaOH, NaNH2, K2O, KOH, and KNH2. (C) 1994 John Wiley & Sons, Inc.

引用

页码：313 / 318

页数：6

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