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Referenced by:
Manuscript title: Collective Descriptors for the Adsorption of Sugar Alcohols on Pt and Pd (111)
Journal: J. Phys. Chem. C
DOI: 10.1021/jp502819s
Full metadata record
DC Field | Value | Language |
---|---|---|
dc.contributor.author | García Muelas, Rodrigo | - |
dc.date.accessioned | 2016-10-21T11:13:22Z | - |
dc.date.available | 2017-10-16T08:07:58Z | - |
dc.date.created | 2016-10-21T13:13:20.863+02:00 | - |
dc.date.issued | 2016-10-21T13:13:20.863+02:00 | - |
dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/1344 | - |
dc.description | 1,2,3-propanetriol | - |
dc.publisher | Institute of Chemical Research of Catalonia | - |
dc.relation | Original title: Collective Descriptors for the Adsorption of Sugar Alcohols on Pt and Pd (111) DOI: 10.1021/jp502819s Journal: J. Phys. Chem. C | - |
dc.relation.uri | http://dx.doi.org/10.1021/jp502819s | - |
dc.rights | CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2016 | - |
dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
dc.title | p6 | - |
dc.type | dataset | - |
dc.date.updated | 2016-10-21T11:13:22Z | - |
cml.program.name | Gaussian | en |
cml.program.version | 09 | en |
cml.program.other | EM64L-G09RevA.02 | en |
cml.method | RB3LYP | en |
cml.spintype | Restricted | en |
cml.calculationtype | Single point Structure | en |
cml.hassolvent | false | en |
cml.hasvibrationalfrequencies | false | en |
cml.numberofjobs | 1 | en |
cml.hasmolecularorbitals | false | en |
Appears in Collections: | Collective Descriptors for the Adsorption of Sugar Alcohols on Pt and Pd(111) - DOI: 10.19061/iochem-bd-1-19 |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/1344