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dc.contributor.authorGarcía Muelas, Rodrigo-
dc.date.accessioned2017-08-09T10:46:45Z-
dc.date.available2017-12-19T08:40:43Z-
dc.date.created2017-08-09T12:46:43.893+02:00-
dc.date.issued2017-08-09T12:46:43.893+02:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/5551-
dc.descriptionCu-1-09-O oxygen-assisted-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2017-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.subjectEthylene glycol-
dc.subjectHydrogen production-
dc.subjectOxygen-assisted-
dc.subjectEthanol-
dc.subjectDecomposition-
dc.subjectReforming-
dc.subjectMicrokinetics-
dc.subjectPoly-alcohols-
dc.subjectTwo transition states-
dc.titleCu-1-09-O-
dc.typedataset-
dc.date.updated2017-08-09T10:46:45Z-
cml.program.namevaspen
cml.program.version5.3.3en
cml.program.other18Dez12 (build Apr 2 2013 14:53:31) complexen
cml.shelltypeClosed shellen
cml.energy.value-181.34706058en
cml.energy.unitseVen
cml.formula.genericC2H6Cu36O2en
cml.calculationtypeImproved Dimer Methoden
cml.hassolventfalseen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
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