ioChem-BD Browse module - Item page
Item metadata and files
Code snippets
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Petrus, Enric | - |
| dc.date.accessioned | 2018-07-22T07:25:19Z | - |
| dc.date.available | 2020-01-14T14:00:23Z | - |
| dc.date.created | 2018-07-22T09:25:17.839+02:00 | - |
| dc.date.issued | 2018-07-22T09:25:17.839+02:00 | - |
| dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/10126 | - |
| dc.description | 5S-State | - |
| dc.publisher | Institute of Chemical Research of Catalonia | - |
| dc.relation | * | |
| dc.rights | CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2018 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | /ExcitedState/5S_State 5S_State | - |
| dc.type | dataset | - |
| dc.date.updated | 2018-07-22T07:25:19Z | - |
| cml.program.name | ADF | en |
| cml.program.version | 2016 | en |
| cml.method | DFT | en |
| cml.basisset | TZP | en |
| cml.multiplicity | 1 | en |
| cml.spintype | Restricted | en |
| cml.formula.generic | H4N2O10U | en |
| cml.calculationtype | Geometry optimization | en |
| cml.hassolvent | false | en |
| cml.hasvibrationalfrequencies | false | en |
| cml.numberofjobs | 1 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | Master Thesis | |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/10126
Item files in Browse 
HTML5 resume (see conditions inside)