DOI: 10.14469/hpc/14402 Metadata
Created: 2024-07-06 11:01
Last modified: 2024-11-25 08:42
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
Null
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| TS3+NH4-2-11.gjf | 400 | chemical/x-gaussian-input | Gaussian input file |
| TS3+NH4-2-11.log | 79KB | chemical/x-gaussian-log | Gaussian log file |
| checkpoint.fchk | 232KB | chemical/x-gaussian-checkpoint | Formatted checkpoint file |
| opt.cml | 521 | chemical/x-cml | Optimised geometry |
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/14521 | Rzepa13 |