anvari_meh at physics.iust.ac.ir
Wed Apr 15 14:03:54 CEST 2009
I read your answers, but I think (it maybe wrong) after density calculating
in each step of vc-rx calculations, the program should use it in the next
step. so because of trivial changes in cell parameters the number of
iterations should decrease in each step, shouldn't?
I have another question about introducing one layer to code. How could I
select c parameter along z direction ,I mean how large it should be? Could I
say if stress along z direction become zero after 2-3 steps in vc-rx my
selection is correct?
Iran University Of Science & Technology
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