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Volumn 50, Issue 5, 2009, Pages 1019-1022

First principles calculations of vacancy formation energies in Σ13 pyramidal twin grain boundary of α-A1 2O 3

Author keywords

alumina; First principles calculation; Grain boundary; Intrinsic defect energetics

Indexed keywords

ATOMIC SITES; ATOMIC STRUCTURE; DEFECT ENERGETICS; FIRST PRINCIPLES CALCULATION; FIRST-PRINCIPLE; FORMATION ENERGIES; INTRINSIC DEFECT ENERGETICS; PROJECTOR-AUGMENTED WAVES; SCHOTTKY DEFECTS; STRUCTURAL DISTORTIONS; VACANCY FORMATION ENERGIES;

EID: 67650490304     PISSN: 13459678     EISSN: None     Source Type: Journal    
DOI: 10.2320/matertrans.MC200825     Document Type: Conference Paper
Times cited : (21)

References (29)
  • 11
    • 0030196678 scopus 로고    scopus 로고
    • T. Höche and M. Rühle: I. Am. Ceram. Soc. 79 (1996) 1961.
    • T. Höche and M. Rühle: I. Am. Ceram. Soc. 79 (1996) 1961.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.