[Wien] [Wien2k Users] The problem of lattice stability of tetragonal lattice

2010-04-26 Thread Ghosh SUDDHASATTWA
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[Wien] errors in lapwso

2010-04-26 Thread Bin Shao
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[Wien] LMO for LSMO

2010-04-26 Thread Lukasz Plucinski
Dear Prof. Blaha and WIEN2k users, Of course I always use w2web :) I was manipulating sphere sizes to avoid leakage of Mn atom, I don't know what went wrong, but its unimportant now. Today I started calculation from the scratch in a new directory. I used automatic RMT calculation in StructGen,