Endo TS1 B3LYP/def2-SVPP Model
DOI: 10.14469/hpc/12987 Metadata
Created: 2023-08-11 12:03
Last modified: 2023-09-21 16:24
License: Creative Commons: Public Domain Dedication 1.0
Funding: (none given)
Description
Portal project
Member of collection / collaboration
| DOI | Description |
|---|---|
| 10.14469/hpc/13057 | Mechanism of the Swern oxidation: Transition state kinetic isotope effect calculations |
Members
| DOI | Description |
|---|---|
| 10.14469/hpc/12988 | Endo_TS1_G16_PCM_DCM_def2svpp_v_01 |
| 10.14469/hpc/12989 | Endo_TS1_G16_PCM_DCM_def2svpp_v_01_reactant |