Ab initio study of ATiO3 (001) surfaces

Surface and Interface Analysis

Volumn 41, Issue 12-13, 2009, Pages 918-923

  Wang, Guo Zhang ^a   Li, Cheng Rong ^a   Cuib, Jie ^b   Manc, Zhen Yong ^c  

^a YULIN UNIVERSITY   (China)

^b XI'AN UNIVERSITY OF TECHNOLOGY   (China)

^c SHANGHAI INSTITUTE OF CERAMICS   (China)

Author keywords

Ab initio; Surface energy; Surface grand potential; Surface relaxation

Indexed keywords

AB INITIO; AB INITIO STUDY; GRAND POTENTIAL; PLANE WAVE; SRTIO; SURFACE ENERGIES; TIO; ULTRASOFT PSEUDOPOTENTIALS;

ARCTIC ENGINEERING; INTERFACIAL ENERGY; LITHIUM COMPOUNDS; SURFACE CHEMISTRY; SURFACE TENSION;

SURFACE RELAXATION;

EID: 72149120035     PISSN: 01422421     EISSN: 10969918     Source Type: Journal    
DOI: 10.1002/sia.3119     Document Type: Article

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