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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Oct-2023alpha-_GeW12O40__4-_PBE0_no_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--583.536718; eV
thumbnail.jpeg30-Oct-2023alpha-_W18O54(PO4)2__6-_PBE0_Acetonitrile_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--919.099894; eV
thumbnail.jpeg30-Oct-2023alpha-_W18O54(PO4)2__6-_PBE0_Water_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--919.775239; eV
thumbnail.jpeg30-Oct-2023_W18O54(SO3)2__4-_PBE0_Acetonitrile_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--879.985713; eV
thumbnail.jpeg30-Oct-2023_W18O54(SO3)2__4-_PBE0_Water_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--880.469165; eV
thumbnail.jpeg30-Oct-2023alpha-_PW12O40__3-_PBE0_no_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--590.549465; eV
thumbnail.jpeg30-Oct-2023alpha-_W18O54(SeO3)2__5_PBE0_no_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--857.846938; eV
thumbnail.jpeg30-Oct-2023_W6O19__2-_PBE0_no_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--281.916987; eV
thumbnail.jpeg30-Oct-2023gamma_-_W18O56(TeO6)__10-_PBE0_no_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--807.867035; eV
thumbnail.jpeg30-Oct-2023_Mo18O54(SO3)2__4-_PBE0_Acetonitrile_TZP_noJacobs, JakeAMS; 2021.106; r99350Geometry optimizationPBE0 == Not Default ==--855.292153; eV
Results 1-10 of 33 (Search time: 0.002 seconds).