Journal Article FZJ-2024-04943

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Hybrid functionals with nonempirical Hartree-Fock parameters for electronic structure calculation of layered oxides

 ;

2024
APS Woodbury, NY

Physical review / B 109(15), 155134 () [10.1103/PhysRevB.109.155134]

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Keyword(s): Energy (1st) ; Condensed Matter Physics (2nd)

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Note: Grant name: DFG project 501562980Disclaimer

Contributing Institute(s):
  1. Werkstoffsynthese und Herstellungsverfahren (IMD-2)
Research Program(s):
  1. 1221 - Fundamentals and Materials (POF4-122) (POF4-122)

Appears in the scientific report 2024
Database coverage:
Medline ; American Physical Society Transfer of Copyright Agreement ; OpenAccess ; Clarivate Analytics Master Journal List ; Current Contents - Electronics and Telecommunications Collection ; Current Contents - Physical, Chemical and Earth Sciences ; Ebsco Academic Search ; Essential Science Indicators ; IF < 5 ; JCR ; SCOPUS ; Science Citation Index Expanded ; Web of Science Core Collection
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 Record created 2024-07-21, last modified 2025-02-03


OpenAccess:
Post_Print_Band_gaps_of_layered_transition_metal_oxides_by_hybrid_functionals_with_different_Hartree_Fock_mixing_parameters_and_consecutive_GW - Download fulltext PDF
PhysRevB.109.155134 - Download fulltext PDF
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