Queries about input and output files, running specific calculations, etc.
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minyork
#1
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by minyork » Fri Sep 14, 2007 8:37 pm
Just wondering, does VASP support B3LYP?
Thanks,
Min
Last edited by minyork on Fri Sep 14, 2007 8:37 pm, edited 1 time in total.
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admin
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#2
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by admin » Mon Sep 17, 2007 10:55 am
the current vasp release (4.6) does not include B3LYP; It is implemented in the future release vasp.5.
Last edited by
admin on Mon Sep 17, 2007 10:55 am, edited 1 time in total.