[Wien] structure optimization and mini. positions

Bing Zhou umbingz at cc.UManitoba.CA
Mon Dec 8 19:23:59 CET 2003


Dear all,

Could you please let me know the papers published about the mini.
positions and optimization of crystal using WIEN2k? can I refine the
stucture from XRD using WIEN2k?

Thanks!


Bing Zhou
Dept. of Geol. Sc.
The Univ. of Manitoba
Canada R3T 2N2
Tel: (204)474-8395



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