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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Jul-2021Ta6O19_0HPetrus, EnricADF; 2019Geometry optimizationPBETZP-9.01670878; Eh
thumbnail.jpeg29-Jul-2021Ta2O7_0HPetrus, EnricADF; 2019Geometry optimizationPBETZP-3.28872224; Eh
thumbnail.jpeg29-Jul-2021TaO4_4HPetrus, EnricADF; 2019Geometry optimizationPBETZP-1.88192986; Eh
thumbnail.jpeg29-Jul-2021Nb10O28_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-13.10047714; Eh
thumbnail.jpeg29-Jul-2021Nb16O49_7HPetrus, EnricADF; 2019Geometry optimizationPBETZP-23.15558296; Eh
thumbnail.jpeg29-Jul-2021Nb6O19_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-8.99111772; Eh
thumbnail.jpeg29-Jul-2021Nb9O27_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-12.72478786; Eh
thumbnail.jpeg29-Jul-2021Nb5O16_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-7.52311255; Eh
thumbnail.jpeg29-Jul-2021Nb6O19_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-8.95366299; Eh
thumbnail.jpeg29-Jul-2021Nb5O16_0HPetrus, EnricADF; 2019Geometry optimizationPBETZP-7.44426849; Eh
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