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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Mar-2021/Tungsten/W11O40_1H W11O40_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-17.49342009; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W12O42_1H W12O42_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-18.41307025; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W2O7_2H W2O7_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-3.02980293; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W12O40_1H_a W12O40_1H_aPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W12O40_0H_a W12O40_0H_aPetrus, EnricADF; 2019Single pointPBETZP-
thumbnail.jpeg2-Mar-2021/Tungsten/W12O42_2H W12O42_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-18.47941202; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W6O22_0H W6O22_0HPetrus, EnricADF; 2019Geometry optimizationPBETZP-9.67521142; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W6O22_2H W6O22_2HPetrus, EnricADF; 2019Geometry optimizationPBETZP-9.77334841; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W3O11_0H W3O11_0HPetrus, EnricADF; 2019Geometry optimizationPBETZP-4.87429787; Eh
thumbnail.jpeg2-Mar-2021/Tungsten/W3O11_1H W3O11_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-4.90060731; Eh
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