[Wien] bulk modules of a cubic perovskite

fatima DFT fatimadft5 at gmail.com
Wed Jan 17 20:37:51 CET 2018


Dear users

How do we determine the exact/appropriate value of bulk modulus in wien2k
if the material is about to report the first time in literature?
I see with the varying method the bulk modules changes significantly.

Thanks,

N. Fatima
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