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SiW10Prod1OptFreq2.runDownload
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dc.contributor.authorMateo, Ana-
dc.date.accessioned2021-10-21T10:37:58Z-
dc.date.available2021-10-22T08:51:07Z-
dc.date.created2021-10-21T12:37:56.574+02:00-
dc.date.issued2021-10-21T12:37:56.574+02:00-
dc.identifier.urihttps://iochem-bd.iciq.es/browse/handle/100/33670-
dc.descriptionOpt&Freq-
dc.publisherInstitute of Chemical Research of Catalonia-
dc.relation.ispartofhttp://dx.doi.org/10.19061/iochem-bd-1-217-
dc.rightsCC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2021-
dc.rights.urihttp://creativecommons.org/licenses/by/4.0/-
dc.titleSiW10_mono-Prod1a-
dc.typedataset-
dc.date.updated2021-10-21T10:37:58Z-
cml.program.nameADFen
cml.program.version2017en
cml.methodBP86en
cml.basissetTZPen
cml.multiplicity1en
cml.spintypeRestricteden
cml.formula.genericC7H24B10N2O38Si3W10en
cml.calculationtypeGeometry optimizationen
cml.hassolventtrueen
cml.hasvibrationalfrequenciestrueen
cml.numberofjobs1en
cml.hasmolecularorbitalsfalseen
Appears in Collections:Keggin & Dawson Decaborate Hybrids - DOI: 10.19061/iochem-bd-1-217



Please use this identifier to cite or link to this item: https://iochem-bd.iciq.es/browse/handle/100/33670

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