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Two‐body potential of the Buckingham type for copper halides
Author(s) -
Mouffok B.,
Feraoun H.,
Aourag H.
Publication year - 2006
Publication title -
physica status solidi (b)
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.51
H-Index - 109
eISSN - 1521-3951
pISSN - 0370-1972
DOI - 10.1002/pssb.200541141
Subject(s) - buckingham , halide , copper , chemistry , type (biology) , body type , zinc , ground state , inorganic chemistry , atomic physics , physics , quantum mechanics , organic chemistry , geology , medicine , paleontology , anatomy
Abstract The ground state, and elastic properties of copper halides in their zinc blende, NaCl and intermediate structures have been calculated using a two‐body potential of the Buckingham type coupled with a molecular dynamics simulation. (© 2006 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim)