To add the frozen core charge to CHGCAR?
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To add the frozen core charge to CHGCAR?
Can I add the charge of " frozen core" to CHGCAR? The PAW potential is used.
Last edited by zhantian on Tue Nov 21, 2006 8:10 am, edited 1 time in total.
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To add the frozen core charge to CHGCAR?
no.
Last edited by admin on Mon Nov 27, 2006 12:28 pm, edited 1 time in total.