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Assessing the source of error in the Thomas-Fermi-von Weizsäcker density functional.
Thapa, Bishal; Jing, Xin; Pask, John E; Suryanarayana, Phanish; Mazin, Igor I.
Affiliation
  • Thapa B; Department of Physics and Astronomy, George Mason University, Fairfax, Virginia 22030, USA.
  • Jing X; Quantum Science and Engineering Center, George Mason University, Fairfax, Virginia 22030, USA.
  • Pask JE; College of Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332, USA.
  • Suryanarayana P; College of Computing, Georgia Institute of Technology, Atlanta, Georgia 30332, USA.
  • Mazin II; Physics Division, Lawrence Livermore National Laboratory, Livermore, California 94550, USA.
J Chem Phys ; 158(21)2023 Jun 07.
Article in En | MEDLINE | ID: mdl-37259998
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Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: J Chem Phys Year: 2023 Document type: Article
Fulltext
Print
XML
PubMed Links
Search on Google

Full text: 1 Collection: 01-internacional Database: MEDLINE Language: En Journal: J Chem Phys Year: 2023 Document type: Article