ERROR WHEN ADDING print debug
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Forum Vet
9:48:00 AM PDT - Fri, Aug 24th 2012
Roger,
Let's check what version of NWChem you are using.
What does the output say at the line that contains the text "nwchem branch" ?
Do you have access to the source code?
If you do, please send the output of the command
grep pbe $NWCHEM_TOP/src/nwdft/input_dft/xc_inp.F