ioChem-BD Browse module - Item page
Item metadata and files
Code snippets
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Benzidi, Hind | - |
| dc.date.accessioned | 2023-10-02T16:31:51Z | - |
| dc.date.available | 2023-10-02T16:31:51Z | - |
| dc.date.created | 2023-10-02T18:31:50.114+02:00 | - |
| dc.date.issued | 2023-10-02T18:31:50.114+02:00 | - |
| dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/65408 | - |
| dc.description | WO4_pbe_vacc | - |
| dc.publisher | Institute of Chemical Research of Catalonia | - |
| dc.relation.ispartof | http://dx.doi.org/10.19061/iochem-bd-1-320 | - |
| dc.rights | CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2023 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | /Non-Periodic_Systems WO4_pbe_vacc | - |
| dc.type | dataset | - |
| dc.date.updated | 2023-10-02T16:31:51Z | - |
| cml.program.name | vasp | en |
| cml.program.version | 5.3.3 | en |
| cml.program.other | 18Dez12 (build Mar 13 2019 16:05:56) complex | en |
| cml.method | DFT | en |
| cml.shelltype | Closed shell | en |
| cml.energy.value | -14.81052131 | en |
| cml.energy.units | eV | en |
| cml.formula.generic | O4W | en |
| cml.calculationtype | Single point | en |
| cml.hassolvent | false | en |
| cml.hasvibrationalfrequencies | false | en |
| cml.numberofjobs | 1 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | Co-del_OER - DOI: 10.19061/iochem-bd-1-320 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/65408
Item files in Browse 
HTML5 resume (see conditions inside)