Dear wien2k users,
I have a query regarding volume optimization in wien2k. "Option 1"
optimizes the volume by keeping a:b:c = constant. Now my question is:
in which case this "Option 1" is applicable?...is it only applicable for
cubic symmetry?
Any response in this regard will be helpful for us. Thanks in advance.
with regards,
--
Shamik Chakrabarti
Senior Research Fellow
Dept. of Physics & Meteorology
Material Processing & Solid State Ionics Lab
IIT Kharagpur
Kharagpur 721302
INDIA
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