Multiconfiguration Pair-Density Functional Theory and Complete Active Space Second Order Perturbation Theory. Bond Dissociation Energies of FeC, NiC, FeS, NiS, FeSe, and NiSe
- Kamal Sharkas
- , Laura Gagliardi
- , Donald G. Truhlar
Research output: Contribution to journal › Article › peer-review
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