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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo6O27_14H Mo6O27_14HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo5O22_6H Mo5O22_6HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo5O22_7H Mo5O22_7HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo4O18_6H Mo4O18_6HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo4O18_8H Mo4O18_8HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W1O6_8H W1O6_8HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo36O128_32H Mo36O128_32HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Molybdenum/Mo36O128_33H Mo36O128_33HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W5O19_2H W5O19_2HPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W5O19_1H W5O19_1HPetrus, EnricADF; 2019Single pointPBETZP-
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