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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg6-Nov-2023AIMD_on_2Pd-CeO2_in_an_0_3V_Å_electric_fieldWu, Tiantianvasp; 6.3.0; 20Jan22 (build Nov 15 2022 14:22:01) complexN/ADFT--428.94877235; eV
Login required6-Nov-20232Pd-CeO2_other_unstable_configuration_1Wu, Tiantianvasp; 6.3.0; 20Jan22 (build Nov 15 2022 14:22:01) complexN/ADFT--429.13170185; eV
Login required6-Nov-20232Ni-CeO2_other_unstable_configuration_4Wu, Tiantianvasp; 6.3.0; 20Jan22 (build Nov 15 2022 14:22:01) complexN/ADFT--431.60621713; eV
Login required6-Nov-2023/CO2RR_on_CeO2 TS2_on_CeO2Wu, Tiantianvasp; 6.3.0; 20Jan22 (build Nov 15 2022 14:22:01) complexN/ADFT--440.64614925; eV
Login required24-May-2023/High_coverage glycolaldehyde_formation_nebMates Torres, Ericvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complexN/ADFT--535.47497588; eV
Login required24-May-2023/High_coverage covered_surfaceMates Torres, Ericvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complexN/ADFT--512.56808342; eV
Login required24-May-2023/Low_coverage deprotonated_formaldehydeMates Torres, Ericvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complexN/ADFT--370.34607994; eV
Login required24-May-2023/Low_coverage adsorbed_formaldehydeMates Torres, Ericvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complexN/ADFT--369.74514832; eV
Login required24-May-2023/Molecules glycolaldehydeMates Torres, Ericvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:49:53) gamma-onlyN/ADFT--45.58862284; eV
Login required24-May-2023/Low_coverage formaldehyde_deprotonation_nebMates Torres, Ericvasp; 6.3.0; 20Jan22 (build Feb 3 2022 13:31:30) complexN/ADFT--369.74514832; eV
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