Molecular dynamics simulation of the pressure-induced phase transition in BaFCl

Radiation Effects and Defects in Solids

Volumn 157, Issue 6-12, 2002, Pages 799-803

  Kurobori, T ^a   Liu, M ^a   Tsunekawa, H ^a   Hirose, Y ^a   Takeuchi, M ^b  

^a KANAZAWA UNIVERSITY   (Japan)

^b FUJITSU LABORATORIES LTD   (Japan)

Author keywords

BaFCl; High pressure; Molecular dynamics; Phase transformation; Point defects

Indexed keywords

COMPUTER SIMULATION; COORDINATION REACTIONS; MOLECULAR DYNAMICS; MOLECULAR STRUCTURE; PHASE TRANSITIONS; PRESSURE EFFECTS;

BAFCL; HIGH PRESSURE; MOLECULAR DYNAMICS SIMULATION; TETRAGONAL STRUCTURE;

BARIUM COMPOUNDS;

EID: 13144292309     PISSN: 10420150     EISSN: 10294953     Source Type: Journal    
DOI: 10.1080/10420150215840     Document Type: Article

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