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Manuscript title: Selective hydrogenolysis of 5-hydroxymethylfurfural to 5 methylfurfural over Au/TiO₂
Journal: Appl. Catal., B
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Morales-Vidal, Jordi | - |
| dc.date.accessioned | 2023-05-01T09:03:13Z | - |
| dc.date.available | 2023-05-20T10:16:08Z | - |
| dc.date.created | 2023-05-01T11:03:11.794+02:00 | - |
| dc.date.issued | 2023-05-01T11:03:11.794+02:00 | - |
| dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/60075 | - |
| dc.description | HMF with two OH on r-TiO₂(110) with one oxygen vacancy | - |
| dc.publisher | Institute of Chemical Research of Catalonia | - |
| dc.relation | Original title: Selective hydrogenolysis of 5-hydroxymethylfurfural to 5 methylfurfural over Au/TiO₂ DOI: 10.1016/j.apcatb.2023.122893 Journal: Appl. Catal., B | * |
| dc.relation.uri | http://dx.doi.org/10.1016/j.apcatb.2023.122893 | * |
| 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 | /Energy-profiles/r-TiO₂-1vac r-HMF_2OH | - |
| dc.type | dataset | - |
| dc.date.updated | 2023-05-01T09:03:13Z | - |
| 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 | -2037.67645102 | en |
| cml.energy.units | eV | en |
| cml.formula.generic | C6H8O162Ti80 | 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: | Selective hydrogenolysis of 5-hydroxymethylfurfural to 5 methylfurfural over Au/TiO₂ - DOI: 10.19061/iochem-bd-1-276 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/60075
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