Dear all:
I also have another problem in single carbon atom calculation for SCF .I
lifted electrionic temperature and achieved self-consistence. However, I do
not know to achieve self-consistence at zero-temperature. Deos anybody have
idea for this problem?
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Xu Lu
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Physics and Astronomy Department
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Michigan State University
East Lansing, MI 48824-2320 USA
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http://www.msu.edu/~luxu
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