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DC FieldValueLanguage
cml.program.namevaspen
cml.program.version5.3.3en
cml.program.other18Dez12 (build Jan 30 2013 18:03:31) complexen
cml.shelltypeClosed shellen
cml.energy.value-664.07555789en
cml.energy.unitseVen
cml.formula.genericN/Aen
cml.calculationtypeGeometry optimizationen
cml.hassolventfalseen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
cml.formula.smilesCC(O)CCC(O)O.[Ru]en
dc.contributor.authorLi, Qiang-
dc.contributor.otherInstitute of Chemical Research of Cataloniaen
dc.date.accessioned2016-12-01T10:03:53Z-
dc.date.accessioned2019-05-04T10:42:00Z-
dc.date.available2016-12-01T10:03:53Z-
dc.date.available2019-05-04T10:42:00Z-
dc.date.created2016-12-01T11:03:51.923+01:00-
dc.date.issued2016-12-01T11:03:51.923+01:00-
dc.identifier.urihttps://www.iochem-bd.org//handle/10/4208-
dc.description12-c-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.relationOriginal title: Interfacial acidity in ligand-modified ruthenium nanoparticles boosts the hydrogenation of levulinic acid to gamma-alerolactone DOI: 10.1039/c6gc02586b Journal: Green Chem.*
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-1-15-
dc.relation.urihttp://dx.doi.org/10.1039/c6gc02586b-
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2016-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.subjectDFT-
dc.subjectRuthenium-
dc.subjectgamma-valerolactone-
dc.subjectInterfacial acidity-
dc.subjectlevulinic acid-
dc.subjectHHDMA-
dc.title/intermediateds 12_c-
dc.typedataset-
dc.date.updated2016-12-01T10:03:53Z-
Appears in Collections:Levulinic Acid hydrogenation to Gamma-Valerolatone

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Manuscript title: Interfacial acidity in ligand-modified ruthenium nanoparticles boosts the hydrogenation of levulinic acid to gamma-alerolactone

Journal: Green Chem.

DOI: 10.1039/c6gc02586b



Please use this identifier to cite or link to this item: https://www.iochem-bd.org//handle/10/4208

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