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abacus

An electronic structure package based on either plane wave basis or numerical atomic orbitals.

Install from the command line
Learn more about packages
$ docker pull ghcr.io/deepmodeling/abacus:3.6.2

Recent tagged image versions

  • latest 3.6.2
    Published 6 months ago · Digest
    sha256:1a8634a2099c3734d109c327bc72dd24a627655ebbd2019f4ee4585220fd5670
    29 Version downloads
  • 3.6.1
    Published 7 months ago · Digest
    sha256:392e58877946b5bc8809c9fce49cfb6300f6490d7c5a062bda05d3fccb3376ab
    33 Version downloads
  • 3.6.0
    Published 7 months ago · Digest
    sha256:5f3a3dd308ae826e56b0e4c992d404e8015acefd1a86829a0651047c6fc9c666
    44 Version downloads
  • 3.5.4
    Published 8 months ago · Digest
    sha256:98a81d842c8925b49fa1d2dfe72098981975fe971348c0f1d231c7da449dfd1b
    51 Version downloads
  • 3.5.3
    Published 9 months ago · Digest
    sha256:2a9701ad79b26e52aa8605e562e0611016a75637238d2227d89e9498b5e463f7
    56 Version downloads
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Details

Last published

6 months ago

Discussions

109

Issues

160

Total downloads

5.66K