HREM and molecular dynamics studies of oxygen-defective LaMnO3-x

被引：1

作者：

Shibahara, H ^{[1
]}

机构：

[1] Kyoto Univ Educ, Dept Chem & Mat Sci, Fushimi Ku, Kyoto 6120863, Japan

来源：

JOURNAL OF ELECTRON MICROSCOPY | 1998年 / 47卷 / 04期

关键词：

molecular dynamics; perovskite; HREM; LaMnO3; oxygen defects; GMR;

D O I：

10.1093/oxfordjournals.jmicro.a023599

中图分类号：

TH742 [显微镜];

学科分类号：

摘要：

The stability of an oxygen-defective structure of LaMnO3-x was studied by MD simulation The relaxed structure based on the MD simulation could provide sufficient adequate information to discuss the proposed structure model of LaMnO3-x compared with the observed image contrast by HREM. Image calculation of the relaxed structure by the multislice method also supported the proposed defect structure model. Analysis of the atomic structure by MD simulation gave the information of oxygen ion and cation migration in oxygen-defective perovskite.

引用

页码：327 / 333

页数：7

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