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FACCTs
faccts.de
did:plc:e6ses5okejrwl6b4nwg565v2
ORCA 6.1 (@faccts.de & @orca-qc-official.bsky.social) will feature various new energy decomposition methods developed by the Bistoni lab. ADLD is one of them, check out the paper https://doi.org/10.1021/acscentsci.5c00356.
#ORCA61 #ORCAqc #CompChem #QuantumChem #ChemSky #CompChemSky
2025-05-22T12:15:41.548Z