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Camilla
Camilla
10:14 AM
dear moderator
I was trying to tag Phil hasnip in his answer to my question
3
A: Extracting band structure data using Boltztrap for Quantum ESPRESSO

Phil HasnipI don't see a way to do this from the command-line, but as BoltzTraP2 is written in Python, you can add it in. This worked for me: Edit "interface.py" and go to the "parse_plotbands" routine. First, we open a file to put our data in, I called it "btp2_plotbands.dat" and put it in the variable out...

But the tag didn't appear
will he receive my comment to his answer?
 

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