Surface science using coupled cluster theory via local Wannier functions and in-RPA-embedding: The case of water on graphitic carbon nitride

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Authors: Tobias Schäfer; Alejandro Gallo; Andreas Irmler; Felix Hummel; Andreas Grüneis

Journal title: The Journal of Chemical Physics

Journal publisher: American Institute of Physics

Published year: 2021

DOI identifier: 10.1063/5.0074936

ISSN: 0021-9606