https://iochem-bd.iciq.es/browse/handle/100/31140 Multivalent-cation-effect-CO2-H2O-reduction Tue, 07 Apr 2026 05:43:14 GMT 2026-04-07T05:43:14Z https://iochem-bd.iciq.es/browse/handle/100/33696 Title: /CO2-protonation Au(111)-3sqrt3x3sqrt3-Al-3H2O-COOH Authors: Dattila, Federico Description: DFT energy for COOH on a Au(111) 3sqrt3x3sqrt3 supercell in presence of 1 Al cation and 3 H2O molecules within cation's solvation shell. Tue, 02 Nov 2021 16:02:53 GMT https://iochem-bd.iciq.es/browse/handle/100/33696 2021-11-02T16:02:53Z https://iochem-bd.iciq.es/browse/handle/100/33695 Title: /CO2-protonation Au(111)-3sqrt3x3sqrt3-Ba-3H2O-COOH Authors: Dattila, Federico Description: DFT energy for COOH on a Au(111) 3sqrt3x3sqrt3 supercell in presence of 1 Ba cation and 3 H2O molecules within cation's solvation shell. Tue, 02 Nov 2021 16:02:50 GMT https://iochem-bd.iciq.es/browse/handle/100/33695 2021-11-02T16:02:50Z https://iochem-bd.iciq.es/browse/handle/100/33694 Title: /CO2-protonation Au(111)-3sqrt3x3sqrt3-Cs-3H2O-COOH Authors: Dattila, Federico Description: DFT energy for COOH on a Au(111) 3sqrt3x3sqrt3 supercell in presence of 1 Cs cation and 3 H2O molecules within cation's solvation shell. Tue, 02 Nov 2021 16:02:47 GMT https://iochem-bd.iciq.es/browse/handle/100/33694 2021-11-02T16:02:47Z https://iochem-bd.iciq.es/browse/handle/100/33693 Title: /CO2-protonation Au(111)-3sqrt3x3sqrt3-Li-3H2O-COOH Authors: Dattila, Federico Description: DFT energy for COOH on a Au(111) 3sqrt3x3sqrt3 supercell in presence of 1 Li cation and 3 H2O molecules within cation's solvation shell. Tue, 02 Nov 2021 16:02:44 GMT https://iochem-bd.iciq.es/browse/handle/100/33693 2021-11-02T16:02:44Z