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| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Solé Daura, Albert | - |
| dc.date.accessioned | 2025-05-06T18:52:53Z | - |
| dc.date.available | 2025-05-06T18:52:53Z | - |
| dc.date.created | 2025-05-06T20:52:51.718794+02:00 | - |
| dc.date.issued | 2025-05-06T20:52:51.718794+02:00 | - |
| dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/97344 | - |
| dc.description | tea_TZ | - |
| dc.publisher | Institute of Chemical Research of Catalonia | - |
| dc.rights | CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2025 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.subject | Organic-inorganic hybrid composites | - |
| dc.subject | Wells-Dawson | - |
| dc.subject | Polyoxometalates | - |
| dc.title | tea_TZ | - |
| dc.type | dataset | - |
| dc.date.updated | 2025-05-06T18:52:53Z | - |
| cml.program.name | Gaussian | en |
| cml.program.version | 16 | en |
| cml.program.other | AM64L-G16RevA.03 | en |
| cml.method | RB3LYP | en |
| cml.basisset | CC-PVTZ GEN | en |
| cml.multiplicity | 1 | en |
| cml.spintype | Restricted | en |
| cml.shelltype | Closed | en |
| cml.charge | 0 | en |
| cml.energy.value | -292.5271814 | en |
| cml.energy.units | Eh | en |
| cml.formula.generic | C6H15N | en |
| cml.calculationtype | Single point Structure | en |
| cml.hassolvent | true | en |
| cml.hasvibrationalfrequencies | false | en |
| cml.numberofjobs | 1 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | photoaccum-Dawson-hybrid | |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/97344
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