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Releases: fishjojo/pyscf

PySCF v2.0.0 release

24 Oct 23:59
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PySCF v2.0.0 release Pre-release
Pre-release

Version 0.4 (2014-08-17):

  • Module "future" for upcoming functions
  • One-line command to run QC calculation with pyscf
  • Fix bug of AO to MO transformation in OpenMP environment

Version 0.3 (2014-07-03):

  • Change import layout

Version 0.2 (2014-05-08):

  • Integral transformation

Version 0.1 (2014-05-03):