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FACCTs
faccts.de
did:plc:e6ses5okejrwl6b4nwg565v2
Check out the recent paper by List, Neese et al. that ones more demonstrates the synergy of experiment and quantum chemistry powered by ORCA (DFT, GOAT, ...) @faccts.de @orca-qc-official.bsky.social
https://doi.org/10.1021/jacs.5c05709
ORCA: www.faccts.de/orca/
#ORCAqc #ORCA #Catalysis #CompChem #QuantumChem
2025-08-19T11:18:51.309Z