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Metadata:
| Title: | tCo-CN+6H2O_tdb3_ccpVTZ@ccpVDZ_smd |
| Authors: | Pearce, Harrison |
| Issue Date: | 18-Apr-2024 |
| Publisher: | Barcelona Supercomputing Center San Diego State University |
| Description: | tCo-CN with 6 waters. TD-B3LYP/cc-pVTZ single point at the cc-pVDZ optimized geometry. Both calculations are done with SMD=water. |
| URI: | https://iochem-bd.bsc.es/browse/handle/100/320090 |
| Appears in Collections: | TD-DFT_Nucleobases_and_nucleobase_analogues - DOI: 10.19061/iochem-bd-6-353 |
Please use this identifier to cite or link to this item:
https://iochem-bd.bsc.es/browse/handle/100/320090
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