Multivalent-cation-effect-CO2-H2O-reduction https://iochem-bd.iciq.es/browse/handle/100/31140 2026-04-07T04:18:42Z 2026-04-07T04:18:42Z Dattila, Federico https://iochem-bd.iciq.es/browse/handle/100/33696 2021-12-24T10:15:26Z 2021-11-02T16:02:53Z

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.

2021-11-02T16:02:53Z Dattila, Federico https://iochem-bd.iciq.es/browse/handle/100/33695 2021-12-24T10:15:26Z 2021-11-02T16:02:50Z

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.

2021-11-02T16:02:50Z Dattila, Federico https://iochem-bd.iciq.es/browse/handle/100/33694 2021-12-24T10:15:25Z 2021-11-02T16:02:47Z

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.

2021-11-02T16:02:47Z Dattila, Federico https://iochem-bd.iciq.es/browse/handle/100/33693 2021-12-24T10:15:27Z 2021-11-02T16:02:44Z

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.

2021-11-02T16:02:44Z