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Referenced by:
Manuscript title: Structure and Reactivity of Supported Hybrid Platinum Nanoparticles for the Flow Hydrogenation of Functionalized Nitroaromatics
Journal: ACS Catal.
Full metadata record
DC Field | Value | Language |
---|---|---|
dc.contributor.author | Almora, Neyvis | - |
dc.date.accessioned | 2015-07-14T10:45:56Z | - |
dc.date.available | 2015-07-14T10:45:56Z | - |
dc.date.created | 2015-07-14T12:45:55.308+02:00 | - |
dc.date.issued | 2015-07-14T12:45:55.308+02:00 | - |
dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/15 | - |
dc.relation | Original title: Structure and Reactivity of Supported Hybrid Platinum Nanoparticles for the Flow Hydrogenation of Functionalized Nitroaromatics DOI: 10.1021/acscatal.5b00885 Journal: ACS Catal. | * |
dc.title | Adsorption_of_ClC6H4NO2_on_Pt(111) | - |
dc.date.updated | 2015-07-14T10:45:56Z | - |
cml.program.name | vasp | en |
cml.program.version | 5.3.3 | en |
cml.program.other | 18Dez12 (build Apr 2 2013 14:53:31) complex | en |
cml.shelltype | Closed shell | en |
cml.energy.value | -534.52984167 | en |
cml.energy.units | eV | en |
cml.formula.generic | N/A | 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: | Hydrogenation of nitroaromatics to aniline on Pt(111), Pt3Pb(111), and Pt(111)-HHDMA |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/15