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Referenced by:
Manuscript title: Co-doped Hydroxyapatite as Photothermal Catalyst for Selective CO2 Hydrogenation
Journal: Appl. Catal., B
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Nikačević, Pavle | - |
| dc.date.accessioned | 2023-02-06T11:29:11Z | - |
| dc.date.available | 2023-04-21T10:53:10Z | - |
| dc.date.created | 2023-02-06T12:29:09.661+01:00 | - |
| dc.date.issued | 2023-02-06T12:29:09.661+01:00 | - |
| dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/53903 | - |
| dc.description | Adsorbed CO | - |
| dc.publisher | Institute of Chemical Research of Catalonia | - |
| dc.relation | Original title: Co-doped Hydroxyapatite as Photothermal Catalyst for Selective CO2 Hydrogenation DOI: 10.1016/j.apcatb.2023.122790 Journal: Appl. Catal., B | * |
| dc.relation.uri | http://dx.doi.org/10.1016/j.apcatb.2023.122790 | * |
| dc.rights | CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2023 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | /Geometries_and_energies/HAP/0001/0H2O CO | - |
| dc.type | dataset | - |
| dc.date.updated | 2023-02-06T11:29:11Z | - |
| cml.program.name | vasp | en |
| cml.program.version | 6.1.0 | en |
| cml.program.other | 28Jan20 (build Feb 27 2020 09:57:40) complex | en |
| cml.method | DFT | en |
| cml.shelltype | Open shell | en |
| cml.energy.value | -675.61753817 | en |
| cml.energy.units | eV | en |
| cml.formula.generic | CH10Ca20O56P12 | 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: | CoHAP_simulations - DOI: 10.19061/iochem-bd-1-263 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/53903
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