Approaching the basis-set limit of the dRPA correlation energy with explicitly correlated and projector augmented-wave methods.
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| Title: | Approaching the basis-set limit of the dRPA correlation energy with explicitly correlated and projector augmented-wave methods. |
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| Authors: | Humer M; Faculty of Physics and Computational Materials Physics and Vienna Doctoral School in Physics, University of Vienna, Boltzmanngasse 5, A-1090 Vienna, Austria., Harding ME; Institut für Nanotechnologie, Karlsruher Institut für Technologie (KIT), Campus Nord, Postfach 3640, D-76021 Karlsruhe, Germany., Schlipf M; VASP Software GmbH, Sensengasse 8, A-1090 Vienna, Austria., Taheridehkordi A; Faculty of Physics and Center for Computational Materials Science, University of Vienna, Kolingasse 14-16, A-1090 Vienna, Austria., Sukurma Z; Faculty of Physics and Computational Materials Physics and Vienna Doctoral School in Physics, University of Vienna, Boltzmanngasse 5, A-1090 Vienna, Austria., Klopper W; Institut für Nanotechnologie, Karlsruher Institut für Technologie (KIT), Campus Nord, Postfach 3640, D-76021 Karlsruhe, Germany., Kresse G; VASP Software GmbH, Sensengasse 8, A-1090 Vienna, Austria. |
| Source: | The Journal of chemical physics [J Chem Phys] 2022 Nov 21; Vol. 157 (19), pp. 194113. |
| Publication Type: | Journal Article |
| Journal Info: | Publisher: American Institute of Physics Country of Publication: United States NLM ID: 0375360 Publication Model: Print Cited Medium: Internet ISSN: 1089-7690 (Electronic) Linking ISSN: 00219606 NLM ISO Abbreviation: J Chem Phys Subsets: MEDLINE; PubMed not MEDLINE |
| Database: | MEDLINE Ultimate |
| FullText | Text: Availability: 0 |
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| Header | DbId: mdl DbLabel: MEDLINE Ultimate An: 36414465 AccessLevel: 2 PubType: Academic Journal PubTypeId: academicJournal PreciseRelevancyScore: 0 |
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| Items | – Name: Title Label: Title Group: Ti Data: Approaching the basis-set limit of the dRPA correlation energy with explicitly correlated and projector augmented-wave methods. – Name: Author Label: Authors Group: Au Data: <searchLink fieldCode="AU" term="%22Humer+M%22">Humer M</searchLink>; Faculty of Physics and Computational Materials Physics and Vienna Doctoral School in Physics, University of Vienna, Boltzmanngasse 5, A-1090 Vienna, Austria.<br /><searchLink fieldCode="AU" term="%22Harding+ME%22">Harding ME</searchLink>; Institut für Nanotechnologie, Karlsruher Institut für Technologie (KIT), Campus Nord, Postfach 3640, D-76021 Karlsruhe, Germany.<br /><searchLink fieldCode="AU" term="%22Schlipf+M%22">Schlipf M</searchLink>; VASP Software GmbH, Sensengasse 8, A-1090 Vienna, Austria.<br /><searchLink fieldCode="AU" term="%22Taheridehkordi+A%22">Taheridehkordi A</searchLink>; Faculty of Physics and Center for Computational Materials Science, University of Vienna, Kolingasse 14-16, A-1090 Vienna, Austria.<br /><searchLink fieldCode="AU" term="%22Sukurma+Z%22">Sukurma Z</searchLink>; Faculty of Physics and Computational Materials Physics and Vienna Doctoral School in Physics, University of Vienna, Boltzmanngasse 5, A-1090 Vienna, Austria.<br /><searchLink fieldCode="AU" term="%22Klopper+W%22">Klopper W</searchLink>; Institut für Nanotechnologie, Karlsruher Institut für Technologie (KIT), Campus Nord, Postfach 3640, D-76021 Karlsruhe, Germany.<br /><searchLink fieldCode="AU" term="%22Kresse+G%22">Kresse G</searchLink>; VASP Software GmbH, Sensengasse 8, A-1090 Vienna, Austria. – Name: TitleSource Label: Source Group: Src Data: <searchLink fieldCode="JN" term="%220375360%22">The Journal of chemical physics</searchLink> [J Chem Phys] 2022 Nov 21; Vol. 157 (19), pp. 194113. – Name: TypePub Label: Publication Type Group: TypPub Data: Journal Article – Name: TitleSource Label: Journal Info Group: Src Data: <i>Publisher: </i><searchLink fieldCode="PB" term="%22American+Institute+of+Physics%22">American Institute of Physics </searchLink><i>Country of Publication: </i>United States <i>NLM ID: </i>0375360 <i>Publication Model: </i>Print <i>Cited Medium: </i>Internet <i>ISSN: </i>1089-7690 (Electronic) <i>Linking ISSN: </i><searchLink fieldCode="IS" term="%2200219606%22">00219606 </searchLink><i>NLM ISO Abbreviation: </i>J Chem Phys <i>Subsets: </i>MEDLINE; PubMed not MEDLINE |
| PLink | https://search.ebscohost.com/login.aspx?direct=true&site=eds-live&db=mdl&AN=36414465 |
| RecordInfo | BibRecord: BibEntity: Identifiers: – Type: doi Value: 10.1063/5.0124019 Languages: – Code: eng Text: English PhysicalDescription: Pagination: StartPage: 194113 Titles: – TitleFull: Approaching the basis-set limit of the dRPA correlation energy with explicitly correlated and projector augmented-wave methods. Type: main BibRelationships: HasContributorRelationships: – PersonEntity: Name: NameFull: Humer M – PersonEntity: Name: NameFull: Harding ME – PersonEntity: Name: NameFull: Schlipf M – PersonEntity: Name: NameFull: Taheridehkordi A – PersonEntity: Name: NameFull: Sukurma Z – PersonEntity: Name: NameFull: Klopper W – PersonEntity: Name: NameFull: Kresse G IsPartOfRelationships: – BibEntity: Dates: – D: 21 M: 11 Text: 2022 Nov 21 Type: published Y: 2022 Identifiers: – Type: issn-electronic Value: 1089-7690 Numbering: – Type: volume Value: 157 – Type: issue Value: 19 Titles: – TitleFull: The Journal of chemical physics Type: main |
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