[Pw_forum] Temperature in pwscf

Khalid Ibne Masood Khalid kimu206 at gmail.com
Sun Oct 26 06:32:27 CET 2014


Dear quantum espresso users,
I have a question regarding temperature in pwscf. I want to investigate the
temperature dependent band gap in graphene. For this, how can I specify
temperature in pwscf code for both relaxation and band calculation. Is it
possible ???

Thank you

Khalid
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