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Item hits:
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | /Catalytic_cycle_3 T1_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.91867213; Eh | ||
 | /Catalytic_cycle_3 I1_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.92917419; Eh | ||
 | /Catalytic_cycle_3 T1_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.91417336; Eh | ||
 | /Catalytic_cycle_3 I1_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.92361524; Eh | ||
 | /Catalytic_cycle_3 I2_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.95410005; Eh | ||
 | /Catalytic_cycle_3 I3_Re_Up_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.96020655; Eh | ||
 | /Catalytic_cycle_3 I3_Si_Down_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.95382283; Eh | ||
 | /Catalytic_cycle_3 I3_Si_Down_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.96295166; Eh | ||
 | /Catalytic_cycle_3 I3_Re_Down_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.95336487; Eh | ||
 | /Catalytic_cycle_3 I3_Re_Down_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.95871520; Eh | ||
 | /Catalytic_cycle_3 I3_Re_Up_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.95481147; Eh | ||
 | /Catalytic_cycle_3 I3_Si_Up_Trans_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.94944034; Eh | ||
 | /Catalytic_cycle_3 I3_Si_Up_Cis_3 | Fianchini, Mauro | Gaussian; 16; AM64L-G16RevA.03 | RM062X | - | -4046.95565851; Eh |
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