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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_4 I1_Et3NHBF4_Cis_4 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -1998.82338932; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_4 T2_Et3NHBF4_Cis_4 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -1998.80332028; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_4 T_scis_strans_Crot | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -230.937033342; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_4 I1_Trans_4 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -1282.09376364; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_4 I1_Cis_4 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -1282.09718875; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_4 T1_Trans_4 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -1282.08456519; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_4 T1_Cis_4 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -1282.08706201; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_3 I3_Si_Down_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -4046.96295166; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_3 I3_Si_Up_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization Minimum | RM062X | - | -4046.95565851; Eh | |||
 | 7-Apr-2019 | /Catalytic_cycle_3 T4Syn_Si_Up_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | Geometry optimization TS | RM062X | - | -4622.87805495; Eh |
Results 321-330 of 353 (Search time: 0.001 seconds).