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dc.contributor.authorDaelman, Nathan-
dc.date.accessioned2018-07-23T17:27:51Z-
dc.date.available2019-08-06T08:40:25Z-
dc.date.created2018-07-23T19:27:49.573+02:00-
dc.date.issued2018-07-23T19:27:49.573+02:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/10957-
dc.descriptionPristine CeO2 surface for the 4O configuration-
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/Pristine_surfaces 4O-
dc.typedataset-
dc.date.updated2018-07-23T17:27:51Z-
cml.program.namevaspen
cml.program.version5.4.4en
cml.program.other18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complexen
cml.methodDFTen
cml.shelltypeClosed shellen
cml.energy.value-850.46366733en
cml.energy.unitseVen
cml.formula.genericCe36O72en
cml.calculationtypeGeometry optimizationen
cml.hassolventfalseen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
Appears in Collections:SA_Pt/CeO2



Please use this identifier to cite or link to this item: https://iochem-bd.iciq.es/browse/handle/100/10957

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