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Version 2.1

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@scemama scemama released this 28 Oct 18:18
· 1959 commits to master since this release
  • Bug fixes
  • CAS-SCF
  • Optimized selection for excited states
  • SCAN functional
  • qp_tunnel for connecting through gateways
  • Requires EZFIO >= 1.6.1
  • Renamed disk_access_nuclear_repulsion
  • Improved scaling of pt2
  • Optimized qp_edit -n
  • qp_edit always displays the 1st 10 000 determinants
  • Updated 6-31g