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Browsing by Author Thompson, Jake

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Showing results 21 to 40 of 71 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkali_Metals K7_PW11O39_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--461.158252; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkali_Metals Li3_PW12O40_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--454.619053; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkali_Metals Li7_PW11O39_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--466.258411; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkali_Metals Na3_PW12O40_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--452.434647; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkali_Metals Na7_PW11O39_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--459.987642; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkali_Metals Na8H_A-PW9O34_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--389.123030; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkali_Metals Na8H_B-PW9O34_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--390.294062; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkyl_Ammonium NH4_3_PW12O40_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--515.721025; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkyl_Ammonium TBA3_PW12O40_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--1301.176481; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkyl_Ammonium TEA3_PW12O40_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--906.990844; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkyl_Ammonium TMA3_PW12O40_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--710.117003; eV
thumbnail.jpeg30-Oct-2023/Explicit_Counterions/Alkyl_Ammonium TPA3_PW12O40_Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--1103.799944; eV
thumbnail.jpeg21-Jun-2023/Functional_Effect/Anionic_Model/M=_Co(III_II) SiW11Co-II-(H2O)O39_6-Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--472.775346; eV
thumbnail.jpeg21-Jun-2023/Functional_Effect/Anionic_Model/M=_Co(III_II) SiW11Co-III-(H2O)O39_5-Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--468.541372; eV
thumbnail.jpeg21-Jun-2023/Functional_Effect/Anionic_Model/M=_Mn(III_II) BW11Mn-II-(H2O)O39_7-Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--478.670975; eV
thumbnail.jpeg21-Jun-2023/Functional_Effect/Anionic_Model/M=_Mn(III_II) BW11Mn-III-(H2O)O39_6-Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--475.024176; eV
thumbnail.jpeg21-Jun-2023/Functional_Effect/Anionic_Model/M=_Mn(III_II) GeW11Mn-II-(H2O)O39_6-Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--469.239447; eV
thumbnail.jpeg21-Jun-2023/Functional_Effect/Anionic_Model/M=_Mn(III_II) GeW11Mn-III-(H2O)O39_5-Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--465.106470; eV
thumbnail.jpeg21-Jun-2023/Functional_Effect/Anionic_Model/M=_Mn(III_II) SiW11Mn-II-(H2O)O39_6-Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--475.530928; eV
thumbnail.jpeg21-Jun-2023/Functional_Effect/Anionic_Model/M=_Mn(III_II) SiW11Mn-III-(H2O)O39_5-Thompson, JakeAMS; 2021.106; r99350Geometry optimizationPBE--471.599188; eV
Showing results 21 to 40 of 71 < previous   next >