Is there any one who made success in the BECT reproduction by Berry Phase Method?
If any one, let me know how to do it.
According to the procedures in the manual, I could not get the same results.
(I have get the same BECT results only from Linear Response Calculation. But, I have to deal with many atoms. So I need to know the Berry Phase Calculation to get BECT)
Thanks very much in advance.
Reproduction of NaF BECT at p.88 in the vasp5.2 manual
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kjt0314
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Reproduction of NaF BECT at p.88 in the vasp5.2 manual
Last edited by kjt0314 on Fri Feb 25, 2011 7:39 am, edited 1 time in total.
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support_vasp
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Re: Reproduction of NaF BECT at p.88 in the vasp5.2 manual
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