rankings / method / DLPNO-CCSD(T) / CBS

DLPNO-CCSD(T) / CBS

DLPNO-CCSD(T) / CBS is a DFT method — WFN class · DLPNO-CCSD(T) + cc-pV[T,Q]Z. ScoreMol scores it on 2 benchmark suites covering Reaction energy, Non-covalent interactions, each run under the same protocol on held-out reference data with cluster-bootstrap confidence intervals.

Suites: MTK-55, NCI-M-300.