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Multicomponent CASSCF Revisited: Large Active Spaces are Needed for Qualitatively Accurate Protonic Densities. (arXiv:2011.06040v1 [physics.chem-ph]) http://arxiv.org/abs/2011.06040
Multicomponent CASSCF Revisited: Large Active Spaces are Needed for Qualitatively Accurate Protonic Densities. (arXiv:2011.06040v1 [physics.chem-ph]) http://arxiv.org/abs/2011.06040