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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo8O35_15H Mo8O35_15HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W3O10_1H W3O10_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-4.31327507; Eh
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo9O38_19H Mo9O38_19HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo9O37_14H Mo9O37_14HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/MoO4_1H MoO4_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W1O6_8H W1O6_8HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W04O15_1H W04O15_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-6.66334591; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W04O15_0H W04O15_0HPetrus, EnricADF; 2019Geometry optimizationPBETZP-6.61835166; Eh
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo36O128_32H Mo36O128_32HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/MoO4_2H MoO4_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-
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