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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_3 I1_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -4046.92361524; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_3 T1_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -4046.91417336; Eh | |||
 | 7-Apr-2019 | /Common_species I0 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -1767.84974492; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_1 T4Anti_Si_Down_Trans_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -2278.24037832; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_1 I3_Si_Down_Trans_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -1473.65927505; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_1 T4Syn_Si_Down_Trans_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -2278.24226991; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_1 T4Syn_Re_Down_Trans_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Single point Structure | RM062X | - | -2278.23161868; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_1 T4Anti_Re_Up_Trans_1 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -2278.24764696; Eh | |||
 | 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 |
Results 341-350 of 353 (Search time: 0.001 seconds).