Computer aided design of nano-structured materials with tailored ionic conductivities

被引：19

作者：

Sayle, DC ^{[1
]}

Doig, JA

Parker, SC

Watson, GW

Sayle, TXT

机构：

[1] Cranfield Univ, RMCS, Dept Environm & Ordnance Syst, Swindon, Wilts, England

[2] Univ Bath, Dept Chem, Bath BA2 7AY, Avon, England

[3] Univ Dublin Trinity Coll, Dept Chem, Dublin 2, Ireland

来源：

PHYSICAL CHEMISTRY CHEMICAL PHYSICS | 2005年 / 7卷 / 01期

基金：

英国工程与自然科学研究理事会;

关键词：

D O I：

10.1039/b413107j

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 show, using simulation techniques, that the high ionic conductivity in BaF2/CaF2 heterolayers is because the interfaces reduce the activation energy barriers to mobility and increase the number of charge carriers.

引用

页码：16 / 18

页数：3

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