A SCRF-CNDO/2 STUDY ON PROTON CONDUCTIVITY MECHANISMS IN HYDRONIUM PERCHLORATE - TOWARDS A QUANTUM CHEMICAL REPRESENTATION OF DEFECTS AND IMPURITIES IN CRYSTALS

被引：30
作者：
ANGYAN, J
ALLAVENA, M
PICARD, M
POTIER, A
TAPIA, O
机构：
[1] SWEDISH UNIV AGR SCI, DEPT CHEM & MOLEC BIOL, S-75007 UPPSALA 7, SWEDEN
[2] CNRS, CTR MECAN ONDULATOIRE APPL, F-75940 PARIS 19, FRANCE
[3] USTI, ACIDES MINERAUX LAB, F-34060 MONTPELLIER, FRANCE
来源：
JOURNAL OF CHEMICAL PHYSICS | 1982年 / 77卷 / 09期
关键词：
D O I：
10.1063/1.444375
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
收藏
页码：4723 / 4733
页数：11
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