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DP-GEN Readme on github

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Post time: 2020-07-06 21:49:25
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Edited by ago at 2020-07-06 14:51


I just noticed a problem in section Run: Main Process of Generator of the readme file on the DP-GEN github. The unit for model_devi_jobs["taut"] and model_devi_jobs["taup"] is fs whereas in the generated Lammps input, with the unit style `metal`, the default time unit is ps. The default value for taut is 0.1 'fs' and 0.1 ps in Lammps input file.
Additionnally, it could be easier for new users if the timestep unit in model_devi_dt (which is in ps) was also explicitely added to the readme, in the table under #Exploration.



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Post time: 2020-07-07 07:43:46
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Edited by amcadmus at 2020-07-07 07:47

The units of taut and taup are ps. We are fixing the typo in readme. Thank your for reporting
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