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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg21-Oct-202112rMates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 18 2020 15:29:06) complexGeometry optimizationDFT--159.20486145; eV
thumbnail.jpeg21-Oct-202121rdMates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 18 2020 15:29:06) complexGeometry optimizationDFT--159.11382297; eV
thumbnail.jpeg21-Oct-202122rMates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 18 2020 15:29:06) complexGeometry optimizationDFT--159.14857771; eV
thumbnail.jpeg21-Oct-202122rdMates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 18 2020 15:29:06) complexGeometry optimizationDFT--159.17020685; eV
thumbnail.jpeg21-Oct-202124rMates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Mar 18 2020 15:29:06) complexGeometry optimizationDFT--159.14341594; eV
thumbnail.jpeg21-Oct-2021Glu_bidentate-1Mates Torres, Ericvasp; 6.2.0; 18Jan21 (build Sep 03 2021 23:55:50) complexGeometry optimizationDFT--384.64045377; eV
thumbnail.jpeg21-Oct-2021BulkMates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 02 2019 15:04:02) complexGeometry optimizationDFT--43.64842110; eV
thumbnail.jpeg17-Apr-2020/Intermediates CO2-_intermediateMates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 24 2018 10:34:10) complexGeometry optimizationDFT--345.55679757; eV
thumbnail.jpeg17-Apr-2020/Surfaces 220_facetMates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 24 2018 10:34:10) complexGeometry optimizationDFT--46.65299292; eV
thumbnail.jpeg17-Apr-2020/H_coverage/MEMI_Znse/Neutral Site_4Mates Torres, Ericvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Oct 24 2018 10:34:10) complexGeometry optimizationDFT--325.17088235; eV
Results 1-10 of 318 (Search time: 0.001 seconds).