Accurate Calculation of Isomerization and Conformational Energies of Larger Molecules Using Explicitly Correlated Local Coupled Cluster Methods in Molpro and ORCA
| Format: | Other/Unknown Material |
|---|---|
| Language: | unknown |
| Published: |
American Chemical Society (ACS)
2023
|
| Subjects: | |
| Online Access: | http://dx.doi.org/10.1021/acs.jctc.3c00270.s001 |
| Description not available. |