Search
Add filters:
Use filters to refine the search results.
Item hits:
Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
28-Feb-2024 | SP_TS-RE_6-members | Alves, Erick | Gaussian; 16; EM64L-G16RevC.01 | Single point Structure | RM06L | DEF2TZVP | -1139.070594; Eh | ||||
28-Feb-2024 | SP_Int9-RE | Alves, Erick | Gaussian; 16; EM64L-G16RevC.01 | Single point Structure | RM06L | DEF2TZVP | -1334.4834297; Eh | ||||
28-Feb-2024 | SP_TS-RE | Alves, Erick | Gaussian; 16; EM64L-G16RevC.01 | Single point Structure | RM06L | DEF2TZVP | -1334.4419831; Eh | ||||
28-Feb-2024 | SP_TS2_C | Alves, Erick | Gaussian; 16; EM64L-G16RevC.01 | Single point Structure | RM06L | DEF2TZVP | -1296.0504363; Eh |
Results 261-264 of 264 (Search time: 0.002 seconds).
Discover
Subject
- 91 Metathesis
- 91 Olefin metathesis
- 90 Arynes
- 90 C-H activation
- 90 DFT
- 90 Homogeneous catalysis
- 90 Palladium
Method
- 1 TD-FC