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Manuscript title: Polarized Ni⁰-Niδ⁺ Catalysts Enable Asymmetric C−C Coupling for Long-Chain Hydrocarbons in Electrochemical CO₂ Reduction
Journal: ACS Catal.
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Cai, Wenwei | - |
| dc.coverage.spatial | ES Barcelona | - |
| dc.date.accessioned | 2025-03-13T04:11:08Z | - |
| dc.date.available | 2025-03-13T04:11:08Z | - |
| dc.date.created | 2025-03-13T05:11:05.71069+01:00 | - |
| dc.date.issued | 2025-03-13T05:11:05.71069+01:00 | - |
| dc.identifier.uri | https://iochem-bd.bsc.es/browse/handle/100/362385 | - |
| dc.description | slow-growth of *CH-*COOH coupling on Nipol | - |
| dc.publisher | Peking University | - |
| dc.relation | Original title: Polarized Ni⁰-Niδ⁺ Catalysts Enable Asymmetric C−C Coupling for Long-Chain Hydrocarbons in Electrochemical CO₂ Reduction Journal: ACS Catal. | * |
| dc.relation.ispartof | http://dx.doi.org/10.19061/iochem-bd-6-481 | - |
| dc.rights | CC BY 4.0 (c) Barcelona Supercomputing Center, 2025 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.subject | C−C Coupling | - |
| dc.subject | polarized-Ni | - |
| dc.subject | CO2RR | - |
| dc.subject | Ab initio calculations | - |
| dc.subject | Catalysis | - |
| dc.title | slow-growth-CH-COOH | - |
| dc.type | dataset | - |
| dc.date.updated | 2025-03-13T04:11:08Z | - |
| cml.program.name | vasp | en |
| cml.program.version | 5.4.4 | en |
| cml.program.other | 18Apr17-6-g9f103f2a35 (build Jul 12 2022 11:38:20) gamma-only | en |
| cml.method | DFT | en |
| cml.shelltype | Open shell | en |
| cml.energy.value | -852.39900812 | en |
| cml.energy.units | eV | en |
| cml.formula.generic | C2H62Ni64O35 | en |
| cml.calculationtype | Ab-Initio Molecular Dynamics | en |
| cml.hassolvent | false | en |
| cml.hasvibrationalfrequencies | false | en |
| cml.numberofjobs | 1 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | Models of polarized--Ni and other Catalysts - DOI: 10.19061/iochem-bd-6-481 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.bsc.es/browse/handle/100/362385
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