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@konpat konpat commented May 8, 2023

Description

As a result of implementing new ISAPT variants, a printout of dipole moments before/after link reassignment was added. This printout does not make any sense for the original FISAPT_LINK_ASSIGNMENT == C variant (there was no link reassignment so what do before and after even mean?).

This PR removes this spurious printout for old link reassignment schemes FISAPT_LINK_ASSIGNMENT == C and FISAPT_LINK_ASSIGNMENT == AB.

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Status

  • Ready for review
  • Ready for merge

@loriab loriab added this to the Psi4 1.8 milestone May 8, 2023
@loriab loriab added the sapt For issues about SAPT and its many flavors. label May 8, 2023
@loriab loriab added this pull request to the merge queue May 9, 2023
Merged via the queue into psi4:master with commit 8c228a4 May 9, 2023
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3 participants