dear all,
is it possible to constrain the lattice parameter optimization?
I mean, can I optimize a and b and "freeze" c?
Other codes give the possibility of doing it. So I just wonder if VASP too can do it
Best,
G
partial optimization
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partial optimization
Last edited by giacomo giorgi on Fri Aug 20, 2010 3:26 am, edited 1 time in total.
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partial optimization
Last edited by forsdan on Sat Aug 21, 2010 10:28 am, edited 1 time in total.