Dear all,
Does VASP5.3.3 support Virtual Crystal Approximation?
If not, is there an alternative way to treat the crystal whose sites are occupied by two or more element types?
Thanks
Virtual Crystal Approximation (VASP5.3.3)
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Virtual Crystal Approximation (VASP5.3.3)
Last edited by buchi25 on Wed Mar 06, 2013 9:00 am, edited 1 time in total.
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Virtual Crystal Approximation (VASP5.3.3)
VCA is in 5.3.3 not implemented.
Last edited by admin on Wed Mar 06, 2013 12:42 pm, edited 1 time in total.
Virtual Crystal Approximation (VASP5.3.3)
OK. Thanks!
Last edited by buchi25 on Wed Mar 06, 2013 1:04 pm, edited 1 time in total.