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Hello every body,
I do some jobs using Pyscf and I want to trace some spectrums, how can i do?
or is there any soft or programs to extract them from log or chk files ?
thanks
The text was updated successfully, but these errors were encountered:
Hello every body,
I do some jobs using Pyscf and I want to trace some spectrums, how can i do?
or is there any soft or programs to extract them from log or chk files ?
thanks
The text was updated successfully, but these errors were encountered: