Local Excitations of a Charged Nitrogen Vacancy in Diamond with Multireference Density Matrix Embedding Theory
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Full Citation
S. Haldar, A. Mitra, M. Hermes, and L. Gagliardi, Local Excitations of a Charged Nitrogen Vacancy in Diamond with Multireference Density Matrix Embedding Theory, J. Phys. Chem. Lett., 2023, 14, 4273–4280. DOI: 10.1021/acs.jpclett.3c00551