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Manuscript title: Nanostructure of nickel-promoted indium oxide catalysts drives selectivity in CO2 hydrogenation
Journal: Nat. Commun.
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | García Muelas, Rodrigo | - |
| dc.date.accessioned | 2020-10-09T17:51:26Z | - |
| dc.date.available | 2021-03-16T18:19:46Z | - |
| dc.date.created | 2020-10-09T19:51:24.932+02:00 | - |
| dc.date.issued | 2020-10-09T19:51:24.932+02:00 | - |
| dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/27279 | - |
| dc.description | CH₃OH on Ni₁-In₂O₃-vac | - |
| dc.publisher | Institute of Chemical Research of Catalonia | - |
| dc.publisher | ETH Zurich | - |
| dc.relation | Original title: Nanostructure of nickel-promoted indium oxide catalysts drives selectivity in CO2 hydrogenation DOI: 10.1038/s41467-021-22224-x Journal: Nat. Commun. | * |
| dc.relation.uri | http://dx.doi.org/10.1038/s41467-021-22224-x | * |
| dc.rights | CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2020 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | Ni1-In2O3-i29 | - |
| dc.type | dataset | - |
| dc.date.updated | 2020-10-09T17:51:26Z | - |
| cml.program.name | vasp | en |
| cml.program.version | 5.4.1 | en |
| cml.program.other | 05Feb16 (build Jul 31 2017 15:54:50) complex | en |
| cml.method | DFT | en |
| cml.shelltype | Open shell | en |
| cml.energy.value | -1122.23717110 | en |
| cml.energy.units | eV | en |
| cml.formula.generic | CH4In80NiO120 | en |
| cml.calculationtype | Geometry optimization | en |
| cml.hassolvent | false | en |
| cml.hasvibrationalfrequencies | false | en |
| cml.numberofjobs | 1 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | Nanostructure of nickel-promoted indium oxide catalysts drives selectivity in CO2 hydrogenation - DOI: 10.19061/iochem-bd-1-183 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/27279
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