[Pw_forum] query on fermi energy
Ajit Vallabhaneni
avallabh at purdue.edu
Sun Jan 15 12:50:30 CET 2012
Any thoughts on my second question regarding the e-ph calculation.
For a give set of q and k points, what is the best way to ensure that all
k+q points are available to avoid the message " q is not a vector in the
dense grid" in the calculations"? I observed that using a dense grid is not
enough sometimes. Do we have to check it outside of the quantum espresso
before the calculation begins?
Thanks
Ajit
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