Code snippets
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Swart, Marcel | - |
| dc.coverage.spatial | ES Barcelona Barcelona | - |
| dc.date.accessioned | 2017-06-09T09:59:28Z | - |
| dc.date.available | 2017-06-09T09:59:28Z | - |
| dc.date.created | 2017-06-09T11:59:26.042+02:00 | - |
| dc.date.issued | 2017-06-09T11:59:26.042+02:00 | - |
| dc.identifier.uri | https://iochem-bd.bsc.es/browse/handle/100/47615 | - |
| dc.description | butterfly08 | - |
| dc.publisher | Barcelona Supercomputing Center | - |
| dc.rights | CC BY 4.0 (c) Barcelona Supercomputing Center, 2017 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | /Butterfly butterfly08 | - |
| dc.type | dataset | - |
| dc.date.updated | 2017-06-09T09:59:27Z | - |
| cml.program.name | ADF | en |
| cml.program.version | en | |
| cml.method | DFT | en |
| cml.basisset | TZ2P | en |
| cml.multiplicity | 9 | en |
| cml.spintype | UNrestricted | en |
| cml.charge | 0 | en |
| cml.formula.generic | Co 1 Fe 2 V 1 | en |
| cml.calculationtype | Single point Quild | en |
| cml.hassolvent | false | en |
| cml.hasvibrationalfrequencies | false | en |
| cml.numberofjobs | 2 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | CoVFeFe | |
Please use this identifier to cite or link to this item:
https://iochem-bd.bsc.es/browse/handle/100/47615
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