H3VO
DOI: 10.14469/hpc/10664 Metadata
Created: 2022-07-11 23:38
Last modified: 2022-07-12 00:00
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
Gaussian 16 (C01) calculation
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| VH3O.gjf | 490 | chemical/x-gaussian-input | Gaussian input file |
| VH3O.log | 265KB | chemical/x-gaussian-log | Gaussian log file |
| checkpoint.fchk | 861KB | chemical/x-gaussian-checkpoint | Formatted checkpoint file |
| opt.cml | 777 | chemical/x-cml | Optimised geometry |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/333 | blog |
Subject Keywords
| Keyword | Value |
|---|---|
| inchi | InChI=1S/O.V.3H |
| inchikey | RPNOMFKLQXVXOJ-UHFFFAOYSA-N |