UnboundLocalError: local variable 'all_sys' referenced before assignment #742
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wangxinxiny
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Could you please provide INCAR for ab initio molecular dynamics by VASP? This tag determines how much will be written to the file OUTCAR ('verbosity tag'). You should set |
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"remove dpdata/systems.py to read the code of virial data." What do you mean by that? I can't get your point. :) |
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Hello, when I run the "nohup dpgen init_bulk param.json machine.json 1>log 2>error &" command, I encountered a problem. The following is my error report. I hope you can help me.
This is the error file:
This is the dpgen.log file:
and I have also tried to manually convert the OUTCAR to data format, but there are still errors as follows:
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