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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg29-Jul-2021V03O10_1HPetrus, EnricADF; 2019Geometry optimizationPBETZP-4.50032053; Eh
thumbnail.jpeg29-Jul-2021TaO3_3HPetrus, EnricADF; 2019Geometry optimizationPBETZP-1.21195659; Eh
thumbnail.jpeg29-Jul-2021H5O2Petrus, EnricADF; 2019Geometry optimizationPBETZP-1.02823881; Eh
thumbnail.jpeg29-Jul-2021H4O2Petrus, EnricADF; 2019Geometry optimizationPBETZP-1.06528563; Eh
thumbnail.jpeg29-Jul-2021H3OPetrus, EnricADF; 2019Geometry optimizationPBETZP-0.47246543; Eh
thumbnail.jpeg29-Jul-2021H2OPetrus, EnricADF; 2019Geometry optimizationPBETZP-0.52905636; Eh
thumbnail.jpeg21-Oct-2021P2W7-di-Prod1Mateo, AnaADF; 2017Geometry optimizationBP86TZP-
thumbnail.jpeg21-Oct-2021H3O+Mateo, AnaADF; 2017Geometry optimizationBP86TZP-
thumbnail.jpeg21-Oct-2021P2W17-mono-OpenMateo, AnaADF; 2017Geometry optimizationBP86TZP-
thumbnail.jpeg21-Oct-2021SiW10-Reactant-openMateo, AnaADF; 2017Geometry optimizationBP86TZP-
Results 1041-1050 of 1315 (Search time: 0.003 seconds).