There is a newer version of the record available.

Published January 24, 2023 | Version rev230124
Software Open

ryokbys/nap: v0.10.17

Authors/Creators

  • 1. Nagoya Institute of Technology

Description

  • let pmd automatically change the number of neighbors, number of boundary atoms (and thus the number of atoms) during MD
  • store information of the above and write out at the end of MD

Files

ryokbys/nap-rev230124.zip

Files (4.7 MB)

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md5:c5c207ceb1501fbba6ba85148f76a554
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Additional details

Related works

Is supplement to
https://github.com/ryokbys/nap/tree/rev230124 (URL)