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Libcint 4.1.0
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@sunqm sunqm released this 17 Feb 01:34
· 124 commits to master since this release
v4.1.0
24dd015
  • Add new Rys roots and weights algorithm
  • Improve integral accuracy for high angular momentum basis
  • Improve integral accuracy for short-range Coulomb integrals
  • Add supports of 2-e integrals up to l=15
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