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Quantum Mechanical Static Dipole Polarizabilities in the QM7b and AlphaML Sho...
Dipole polarizabilities (and other molecular properties) computed using linear response coupled cluster theory (LR-CCSD/d-aug-cc-pVDZ) and hybrid density functional theory... -
Coupled-Cluster Polarizabilities in the QM7b and a Showcase Database
Dipole polarizabilities, computed using linear response coupled cluster theory and density functional theory (using d-aug-cc-pVDZ basis set), for 7211 molecules from the QM7b... -
Coupled-Cluster Polarizabilities in the QM7b and a Showcase Database
Dipole polarizabilities, computed using linear response coupled cluster theory and density functional theory (using d-aug-cc-pVDZ basis set), for 7211 molecules from the QM7b...
