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Manuscript title: Photoreduction Mechanism of CO2 to CO Catalyzed by a Rhenium(I)–Polyoxometalate Hybrid Compound
Journal: ACS Catal.
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Poblet, Josep M. | - |
| dc.coverage.spatial | ES Tarragona | - |
| dc.date.accessioned | 2018-02-16T10:14:06Z | - |
| dc.date.available | 2018-02-16T10:14:06Z | - |
| dc.date.created | 2018-02-16T11:14:04.224+01:00 | - |
| dc.date.issued | 2018-02-16T11:14:04.224+01:00 | - |
| dc.identifier.uri | https://iochem-bd.urv.es/browse/handle/100/421 | - |
| dc.description | Compound3apostrophe | - |
| dc.publisher | Universitat Rovira i Virgili | - |
| dc.relation | Original title: Photoreduction Mechanism of CO2 to CO Catalyzed by a Rhenium(I)–Polyoxometalate Hybrid Compound DOI: 10.1021/acscatal.6b01638 Journal: ACS Catal. | - |
| dc.relation.ispartof | http://dx.doi.org/10.19061/iochem-bd-2-1 | - |
| dc.relation.uri | http://dx.doi.org/10.1021/acscatal.6b01638 | - |
| dc.rights | CC BY 4.0 (c) Universitat Rovira i Virgili, 2018 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | Compound3apostrophe | - |
| dc.type | dataset | - |
| dc.date.updated | 2018-02-16T10:14:06Z | - |
| cml.program.name | Gaussian | en |
| cml.program.version | 09 | en |
| cml.program.other | EM64L-G09RevA.02 | en |
| cml.method | UB3LYP | en |
| cml.multiplicity | 3 | en |
| cml.spintype | Unrestricted | en |
| cml.shelltype | open | en |
| cml.charge | -3 | en |
| cml.energy.value | -6168.34694731 | en |
| cml.energy.units | Eh | en |
| cml.formula.generic | C26H25N3O50PRe1NaW12 | en |
| cml.calculationtype | Geometry optimization Minimum | en |
| cml.hassolvent | true | en |
| cml.hasvibrationalfrequencies | true | en |
| cml.numberofjobs | 2 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | ReCO2 - DOI: 10.19061/iochem-bd-2-1 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.urv.es/browse/handle/100/421
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