Relativistic EOM-CCSD for Core-Excited and Core-Ionized State Energies Based on the Four-Component Dirac–Coulomb(−Gaunt) Hamiltonian-Reference-Cited by-同舟云学术

Relativistic EOM-CCSD for Core-Excited and Core-Ionized State Energies Based on the Four-Component Dirac–Coulomb(−Gaunt) Hamiltonian

Author:

Halbert Loïc¹,Vidal Marta L.²^ORCID,Shee Avijit³^ORCID,Coriani Sonia²^ORCID,Severo Pereira Gomes André¹^ORCID

Affiliation:

1. CNRS, UMR 8523—PhLAM—Physique des Lasers, Atomes et Molécules, Université de Lille, F-59000 Lille, France

2. DTU Chemistry—Department of Chemistry, Technical University of Denmark, DK-2800 Kongens Lyngby, Denmark

3. Department of Chemistry, University of Michigan, Ann Arbor, Michigan 48109, United States

Funder

Danmarks Tekniske Universitet

Agence Nationale de la Recherche

European Regional Development Fund

Det Frie Forskningsr?d

Ministre de l'Enseignement sup?rieur, de la Recherche et de l'Innovation

Regional Council of Hauts-de-France

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

Reference131 articles.

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