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Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
---|---|---|---|---|---|---|---|---|
/CO2_reduction/alloy COOH_ads_NiCu | Ding, Yanyan | vasp; 5.4.1; 24Jun15 (build May 18 2016 17:04:48) complex | DFT | - | -736.12240233; eV | |||
/CO2_reduction/alloy HCOO_ads_NiCu | Ding, Yanyan | vasp; 5.4.1; 24Jun15 (build May 18 2016 17:04:48) complex | DFT | - | -736.76471658; eV |
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