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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu13-1Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--32.11151883; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu13-2Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--32.25186835; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu13-3Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--31.90709776; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--35.22009479; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-10Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--33.89430922; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-15Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--32.56675404; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-20Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--31.00817120; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-25Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--29.31742928; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-5Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--34.84644925; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-m10Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--32.99676677; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-m15Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--29.45733016; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-m20Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--23.34198972; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-m25Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--13.59639532; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu14-m5Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--34.73620949; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu15Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--38.57038866; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu19Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--51.36324003; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu19-10Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--49.37422431; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu19-15Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--47.38670604; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu19-20Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--45.05672755; eV
thumbnail.jpeg1-Mar-2024/Metal_structures/Cu_structures Cu19-25Strugovshchikov, Evgeniivasp; 5.3.5; 31Mar14 (build Oct 30 2014 12:56:31) complexGeometry optimizationDFT--42.54085074; eV