| 12:08:34 AM PDT - Sat, Oct 12th 2019 |
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Prnt_xyz command does not provide an output
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| I am new to Nwchem, I was trying to run the sample input given for ground state MD in the documentation, this input lines have print_xyz 5, which I expect would output an xyz file with all the trajectory details.I could not obtain this file even after successful completion of MD run.Do we have to specify something else in the script?
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