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Formulation and implementation of the relativistic Fock-space coupled cluster method for molecules

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    Abstract

    An overview is given on the implementation of the Fock-space coupled cluster method in the one-hole and one-particle sectors in the MOLFDIR and DIRAC program systems. Pilot applications to the I
    Original languageEnglish
    Pages (from-to)9720-9726
    JournalJournal of Chemical Physics
    Volume115
    Issue number21
    DOIs
    Publication statusPublished - 2001

    UN SDGs

    This output contributes to the following UN Sustainable Development Goals (SDGs)

    1. SDG 7 - Affordable and Clean Energy
      SDG 7 Affordable and Clean Energy

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