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dc.contributor.authorDaelman, Nathan-
dc.date.accessioned2018-07-23T17:23:55Z-
dc.date.available2019-08-06T08:40:40Z-
dc.date.created2018-07-23T19:23:53.172+02:00-
dc.date.issued2018-07-23T19:23:53.172+02:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/10859-
dc.descriptionTS: CO to CO2 on Pt-4O-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2018-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.title/Reaction_Paths/CO-oxidation/4O Pt-OC-O_surf-
dc.typedataset-
dc.date.updated2018-07-23T17:23:55Z-
cml.program.namevaspen
cml.program.version5.4.4en
cml.program.other18Apr17-6-g9f103f2a35 (build Jan 31 2018 20:07:36) complexen
cml.methodDFTen
cml.shelltypeOpen shellen
cml.energy.value-871.89213274en
cml.energy.unitseVen
cml.formula.genericCCe36O73Pten
cml.calculationtypeSingle pointen
cml.hassolventfalseen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
Appears in Collections:SA_Pt/CeO2 - DOI: 10.19061/iochem-bd-1-78



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