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Manuscript title: The Interplay between Homogeneous and Heterogeneous Phases of PdAu Catalysts for the Oxidation of Alcohols

Journal: ACS Catal.

DOI: 10.1021/acscatal.6b00832

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DC FieldValueLanguage
dc.contributor.authorJover Modrego, Jesús-
dc.date.accessioned2016-05-09T14:37:57Z-
dc.date.available2016-05-09T14:37:57Z-
dc.date.created2016-05-09T16:37:56.473+02:00-
dc.date.issued2016-05-09T16:37:56.473+02:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/608-
dc.descriptiondioxygen, triplet state-
dc.relationOriginal title: The Interplay between Homogeneous and Heterogeneous Phases of PdAu Catalysts for the Oxidation of Alcohols DOI: 10.1021/acscatal.6b00832 Journal: ACS Catal.*
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-1-6-
dc.rightshttp://creativecommons.org/licenses/by/4.0/-
dc.titleO2-
dc.date.updated2016-05-09T14:37:57Z-
cml.program.nameGaussianen
cml.program.version09en
cml.program.otherEM64L-G09RevA.02en
cml.methodUPBEPBEen
cml.multiplicity3en
cml.spintypeUnrestricteden
cml.shelltypeopenen
cml.charge0en
cml.energy.value-150.189324272en
cml.energy.unitsEhen
cml.formula.genericO2en
cml.calculationtypeGeometry optimization Minimumen
cml.hassolventtrueen
cml.hasvibrationalfrequenciestrueen
cml.numberofjobs2en
cml.hasmolecularorbitalsfalseen
Appears in Collections:The interplay between homogeneous and heterogeneous phases of PdAu catalysts for the oxidation of alcohols



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