[QE-users] How to find the total energy of a wavefunction
John McFarland
jm18ec at my.fsu.edu
Sun Feb 17 18:15:06 CET 2019
Dear all,
I would like to find the total energy of a wavefunction and charge density that were produced without using SCF. Is there a series of subroutines I could use to achieve this?
Best regards,
John McFarland
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