Open AccessAn ab initio study of TiC: A comparison of different levels of theory including density functional methods
Author(s) -
Michael D. Hack,
Robert G. A. R. Maclagan,
Gustavo E. Scuseria,
Mark S. Gordon
Publication year - 1996
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.471381
Subject(s) - density functional theory , ab initio , computational chemistry , ground state , materials science , molecular physics , chemistry , atomic physics , physics , quantum mechanics
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