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Periodic Electronic Structure Calculations With Density Matrix Embedding Theory

Electronic Structure - Methods

Publication Details

  • Authors: H. Q. Pham, M. R. Hermes, and L. Gagliardi
  • Publication Number: 350
  • Year: 2020
  • Journal: J. Chem. Theory Comput.

Full Citation

H. Q. Pham, M. R. Hermes, and L. Gagliardi, Periodic Electronic Structure Calculations With Density Matrix Embedding Theory, J. Chem. Theory Comput., 2020, 16, 130–140. DOI: 10.1021/acs.jctc.9b00939