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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Mar-2021/Tungsten/W5O19_0H W5O19_0HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W12O42_2H W12O42_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-18.47941202; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W3O11_2H W3O11_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-4.89810842; Eh
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo8O35_13H Mo8O35_13HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo7O31_13H Mo7O31_13HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo3O10_7H Mo3O10_7HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo1O6_7H Mo1O6_7HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo18O65_16H Mo18O65_16HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo7O23_1H Mo7O23_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo4O18_8H Mo4O18_8HPetrus, EnricADF; 2019Single pointPBETZP-
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