ioChem-BD Browse module - Item page
Item metadata and files
Code snippets
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Otten, Edwin | - |
| dc.coverage.spatial | Spain ES | - |
| dc.date.accessioned | 2016-09-09T10:46:04Z | - |
| dc.date.available | 2016-09-09T10:46:04Z | - |
| dc.date.created | 2016-09-09T12:46:03.24+02:00 | - |
| dc.date.issued | 2016-09-09T12:46:03.24+02:00 | - |
| dc.identifier.uri | https://iochem.udg.edu:8443/browse/handle/100/12 | - |
| dc.description | turbomole | - |
| dc.publisher | UdG | - |
| dc.relation | Journal: JACS | * |
| dc.rights | CC BY 4.0 (c) UdG, 2016 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | verdazyl | - |
| dc.type | dataset | - |
| dc.date.updated | 2016-09-09T10:46:04Z | - |
| cml.program.name | TURBOMOLE | en |
| cml.program.version | 6.4 | en |
| cml.method | U-DFT | en |
| cml.basisset | def2-TZVP | en |
| cml.multiplicity | 1 | en |
| cml.charge | 0.000000 | en |
| cml.formula.generic | C 8 H 12 N 8 O 2 | 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: | test | |
Please use this identifier to cite or link to this item:
https://iochem.udg.edu/browse/handle/100/12
Item files in Browse 
HTML5 resume (see conditions inside)