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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Jul-2021V05O14_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-6.06931977; Eh
thumbnail.jpeg29-Jul-2021V01O4_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-1.85877485; Eh
thumbnail.jpeg29-Jul-2021V01O4_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-1.83716855; Eh
thumbnail.jpeg29-Jul-2021Ta7O22_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-10.44680634; Eh
thumbnail.jpeg29-Jul-2021Ta10O28_0HPetrus, EnricADF; 2019Geometry optimizationPBETZP-13.29731154; Eh
thumbnail.jpeg29-Jul-2021TaO3_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-1.29054807; Eh
thumbnail.jpeg29-Jul-2021Nb7O22_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-10.32369093; Eh
thumbnail.jpeg29-Jul-2021NbO3_3HPetrus, EnricADF; 2019Geometry optimizationPBETZP-1.20018597; Eh
thumbnail.jpeg29-Jul-2021Nb9O27_0HPetrus, EnricADF; 2019Geometry optimizationPBETZP-12.63142418; Eh
thumbnail.jpeg29-Jul-2021Nb8O25_3HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
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