Dear all:
I have a very step-in question: when optimizing the lattice,should the
magnetism calculation be included ? or just the none spin-polarized calculation
is OK ? I think that for a solid possessing magnetism the magnetism calculation
should be used to obtain the relaxed lattice in optimizing lattice. am I right?
Any suggestion is greatly appreciated .
Thanks very much !
Wenmei Ming
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http://cnweb.search.live.com/video/results.aspx?q=%E5%8F%AF%E7%88%B1%E7%8C%AB%E5%92%AA&Form=MEVHAA
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