has anybody used phase factor in LORBIT = 12?
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has anybody used phase factor in LORBIT = 12?
I tried many possible ways to use the data in PROCAR. none of them matches my band projectrion expectation. Should I turn to the source code, can anybody give me some suggestions?
Last edited by centauris on Fri Oct 19, 2007 1:13 am, edited 1 time in total.