Endo TS1 G03 B3LYP/6-31+G(d,p) Model
DOI: 10.14469/hpc/12975 Metadata
Created: 2023-08-11 11:33
Last modified: 2023-08-25 14:39
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/12982 | Endo_TS1_G03_PCM_DCM_v_01 |
| 10.14469/hpc/12983 | Endo_TS1_G03_PCM_DCM_v_01_reactant |
| 10.14469/hpc/12980 | Endo_TS1_G03_PCM_chloroform_v_01 |
| 10.14469/hpc/12981 | Endo_TS1_G03_PCM_chloroform_v_01_reactant |
| 10.14469/hpc/12978 | Endo_TS1_G03_PCM_chlorobenzene_v_01 |
| 10.14469/hpc/12979 | Endo_TS1_G03_PCM_chlorobenzene_v_01_reactant |
| 10.14469/hpc/12977 | Endo_TS1_G03_PCM_carbon_tetrachloride_v_01 |
| 10.14469/hpc/12976 | Endo_TS1_G03_PCM_carbon_tetrachloride_v_01_reactant |