[Pw_forum] How to get optimized celldm parameters?
YVVishnevsky at yandex.ru
Sat Oct 13 17:29:40 CEST 2012
I have a general question. Let's suppose I've done cell optimization and
would like to restart calculation using optimized celldm parameters.
What is the simplest way to extract them from pw.x log file? In case of
a triclinic (ibrav=14) cell it does not look simple to convert printed
in output components of v1, v2 and v3 to celldm parameters.
Yura V. Vishnevskiy
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