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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg19-Jan-2026pt_h_5_redo_top_freqBrennan-Pollak, Conorvasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complexFrequenciesDFT--85.23266997; eV
thumbnail.jpeg19-Jan-2026pt_h_5_redo_topBrennan-Pollak, Conorvasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complexGeometry optimizationDFT--85.22481813; eV
thumbnail.jpeg19-Jan-2026pt_oh_1_top_freqBrennan-Pollak, Conorvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complexFrequenciesDFT--76.32294425; eV
thumbnail.jpeg19-Jan-2026pt_h_5_redo_freqBrennan-Pollak, Conorvasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complexFrequenciesDFT--84.79784074; eV
thumbnail.jpeg19-Jan-2026pt_oh_1_topBrennan-Pollak, Conorvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complexGeometry optimizationDFT--75.68590341; eV
thumbnail.jpeg19-Jan-2026pt_h_5_dipoleBrennan-Pollak, Conorvasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complexGeometry optimizationDFT--85.41608556; eV
thumbnail.jpeg19-Jan-2026pt_h_5_redoBrennan-Pollak, Conorvasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complexGeometry optimizationDFT--84.79784918; eV
thumbnail.jpeg19-Jan-2026pt_h_5Brennan-Pollak, Conorvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complexGeometry optimizationDFT--85.42358881; eV
thumbnail.jpeg19-Jan-2026pt_h_5_freqBrennan-Pollak, Conorvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complexFrequenciesDFT--85.42228654; eV
thumbnail.jpeg19-Jan-2026ag_constant_potential_o_1_1_006_baderBrennan-Pollak, Conorvasp; 6.2.0; 18Jan21 (build Sep 03 2021 22:41:43) complexSingle pointDFT--23.67659913; eV
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