[Wien] C/A, Vol. optimization : Monoclinic

Ashwani Kumar ashwani.ism at gmail.com
Fri Dec 14 13:02:45 CET 2018


Hi,
  C/a, Volume optimization performed for Monoclinic structure (Ta-doped
Hafnia). Obtained the EOS (equation of state), Bulk modulus values (from
case.outputeos) but where to get the optimized lattice parameters value of
monoclinic cell.

Regards,
A. Kumar
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