linker_raman

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File	Description	Size	Format	Retrieve
raman.in		945 B	ADF file	Download
output.cml		41.56 kB	Chemical Markup Language	Download

Referenced by:

Manuscript title: Direct Observation of the Formation Pathway of [Mo 132] Keplerates

Journal: Inorg. Chem.

Full metadata record

DC Field	Value	Language
dc.contributor.author	Melgar, Dolores	-
dc.date.accessioned	2017-03-27T19:46:11Z	-
dc.date.available	2017-05-31T07:21:27Z	-
dc.date.created	2017-03-27T21:46:10.44+02:00	-
dc.date.issued	2017-03-27T21:46:10.44+02:00	-
dc.identifier.uri	https://iochem-bd.iciq.es/browse/handle/100/1954	-
dc.description	Raman: linker Mo132	-
dc.publisher	Institute of Chemical Research of Catalonia	-
dc.relation	Original title: Direct Observation of the Formation Pathway of [Mo 132] Keplerates DOI: 10.1021/acs.inorgchem.5b02570 Journal: Inorg. Chem.	*
dc.relation.uri	http://dx.doi.org/10.1021/acs.inorgchem.5b02570	-
dc.rights	CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2017	-
dc.rights.uri	http://creativecommons.org/licenses/by/4.0/	-
dc.subject	keplerates	-
dc.subject	Nanostructures	-
dc.subject	Polyoxometalates	-
dc.title	linker_raman	-
dc.type	dataset	-
dc.date.updated	2017-03-27T19:46:11Z	-
cml.program.name	ADF	en
cml.program.version	2010	en
cml.program.other	01	en
cml.method	DFT	en
cml.basisset	TZP	en
cml.multiplicity	1	en
cml.spintype	Restricted	en
cml.charge	-2	en
cml.formula.generic	H4Mo2O8	en
cml.calculationtype	Frequencies	en
cml.hassolvent	true	en
cml.hasvibrationalfrequencies	false	en
cml.numberofjobs	4	en
cml.hasmolecularorbitals	false	en
Appears in Collections:	Raman spectra of species observed during the formation of [Mo 132] Keplerates - DOI: 10.19061/iochem-bd-1-32

Please use this identifier to cite or link to this item: https://iochem-bd.iciq.es/browse/handle/100/1954

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