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| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Benzidi, Hind | - |
| dc.date.accessioned | 2024-05-08T09:10:41Z | - |
| dc.date.available | 2024-05-08T09:10:41Z | - |
| dc.date.created | 2024-05-08T11:10:39.581644+02:00 | - |
| dc.date.issued | 2024-05-08T11:10:39.581644+02:00 | - |
| dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/68845 | - |
| dc.description | CoMoO4_surf_conf1 | - |
| dc.publisher | Institute of Chemical Research of Catalonia | - |
| dc.rights | CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2024 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | /CoMoO4 CoMoO4_surf_conf1 | - |
| dc.type | dataset | - |
| dc.date.updated | 2024-05-08T09:10:41Z | - |
| cml.program.name | vasp | en |
| cml.program.version | 5.3.3 | en |
| cml.program.other | 18Dez12 (build Mar 13 2019 16:05:56) complex | en |
| cml.method | DFT | en |
| cml.shelltype | Closed shell | en |
| cml.energy.value | -363.52899258 | en |
| cml.energy.units | eV | en |
| cml.formula.generic | Co8Mo8O32 | 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: | Co-del_OER - DOI: 10.19061/iochem-bd-1-320 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/68845
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