[Pw_forum] spin-orbit interaction + pressure

Максим Арсентьев ars21031960 at gmail.com
Mon Nov 28 18:53:36 CET 2016


Dear Lorenzo,

I have a question too.
How to get accurate total energy calculations for phase diagrams?
I have read 2 papers from respective journals dealing with the same object
but having (!) different results.
In my calls I have result which is medium between these two papers.

Thank you, Maxim.
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