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Density Matrix Embedding Pair-Density Functional Theory for Molecules

Electronic Structure - Methods

Publication Details

  • Authors: S. Verma, M. R. Hermes, and L. Gagliardi
  • Publication Number: 499
  • Year: 2025
  • Journal: ChemRxiv
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Full Citation

S. Verma, M. R. Hermes, and L. Gagliardi, Density Matrix Embedding Pair-Density Functional Theory for Molecules, ChemRxiv, 2025. DOI: 10.26434/chemrxiv-2025-rz7bq