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Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
---|---|---|---|---|---|---|---|---|---|---|---|
![]() | 7-Apr-2019 | /Catalytic_cycle_1 I3_Re_Up_Trans_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -1473.66026869; Eh | |||
![]() | 7-Apr-2019 | /Catalytic_cycle_1 T4Syn_Re_Up_Trans_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -2278.24935864; Eh | |||
![]() | 7-Apr-2019 | /Catalytic_cycle_1 T4Anti_Si_Up_Cis_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -2278.23981902; Eh | |||
![]() | 7-Apr-2019 | /Catalytic_cycle_1 T4Syn_Si_Up_Cis_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -2278.25584049; Eh |
Results 191-194 of 194 (Search time: 0.001 seconds).
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Subject
- 194 Annulation
- 194 Asymmetric catalysis
- 194 Cycloaddition
- 194 NHC catalysis
Program name
- 194 Gaussian
Calculation type
Method
- 194 RM062X