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DC FieldValueLanguage
cml.program.nameADFen
cml.program.version2019en
cml.methodPBE0 == Not Default ==en
cml.basissetTZPen
cml.multiplicity1en
cml.spintypeRestricteden
cml.charge0en
cml.energy.value-1.36240350en
cml.energy.unitsEhen
cml.formula.genericH4O2en
cml.calculationtypeGeometry optimizationen
cml.hassolventtrueen
cml.hasvibrationalfrequenciesfalseen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
cml.formula.smilesOen
cml.formula.smilesOen
cml.formula.smilesOen
dc.contributor.authorPetrus, Enric-
dc.contributor.otherInstitute of Chemical Research of Cataloniaen
dc.date.accessioned2020-07-24T10:00:52Z-
dc.date.accessioned2020-07-30T15:31:54Z-
dc.date.available2020-07-30T15:00:21Z-
dc.date.available2020-07-30T15:31:54Z-
dc.date.created2020-07-24T12:00:51.31+02:00-
dc.date.issued2020-07-24T12:00:51.31+02:00-
dc.identifier.urihttps://www.iochem-bd.org//handle/10/220730-
dc.description2H2O_PBE0-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.publisherUniversitat Roviri i Virgili-
dc.relationOriginal title: Nucleation Mechanisms and Speciation of Metal Oxide Clusters DOI: 10.1039/D0SC03530K Journal: Chem. Sci.*
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-1-178-
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2020-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.title2H2O_PBE0-
dc.typedataset-
dc.date.updated2020-07-24T10:00:52Z-
Appears in Collections:Nucleation Mechanisms and Speciation of Metal Oxide Clusters

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Manuscript title: Nucleation Mechanisms and Speciation of Metal Oxide Clusters

Journal: Chem. Sci.

DOI: 10.1039/D0SC03530K



Please use this identifier to cite or link to this item: https://www.iochem-bd.org//handle/10/220730

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