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Formation dynamics of graphite intercalation compounds: An {\em ab initio} study
Formation dynamics of graphite intercalation compounds: An {\em ab initio} study
2010
Bo Song
Haiping Fang
David Tom anek
Keywords:
Computational chemistry
Canonical ensemble
Intercalation (chemistry)
SIESTA (computer program)
Ab initio
Graphite
Physical chemistry
Chemistry
Materials science
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