[QE-users] Momentum matrix element on PBE+U
Shivesh Sivakumar
shiveshsivakumar at gmail.com
Wed May 13 08:14:25 CEST 2020
Hello users,
Sorry for the repost, but I think my question went unnoticed.
Is there a way to calculate the momentum matrix element in PBE+U on QE? I
encounter this error: 'Error in routine write_p_avg (1): write_p_avg not
working with LDA+U'. Is there a way to circumvent this on Quantum Espresso?
Best,
Shivesh Sivakumar
University of Washington
Seattle-WA, 98105
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