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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 1-Jun-2022 | TS_J_K_acc | Laconsay, Croix | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | - | DEF2SVP | -1598.13504430; Eh | |||
 | 1-Jun-2022 | TS_C_D_acc | Laconsay, Croix | Gaussian; 16; AS64L-G16RevC.01 | Geometry optimization TS | - | DEF2SVP | -1598.13168584; Eh | |||
 | 1-Jun-2022 | K_acc | Laconsay, Croix | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | - | DEF2SVP | -1598.22455525; Eh | |||
 | 1-Jun-2022 | F_acc | Laconsay, Croix | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | - | DEF2SVP | -1598.21590532; Eh | |||
 | 1-Jun-2022 | A_acc | Laconsay, Croix | Gaussian; 16; AS64L-G16RevC.01 | Geometry optimization Minimum | - | DEF2SVP | -572.013462141; Eh | |||
 | 1-Jun-2022 | TS_U_2 | Laconsay, Croix | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | - | DEF2SVP | -1176.05930412; Eh | |||
 | 1-Jun-2022 | Int_U_2 | Laconsay, Croix | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | - | DEF2SVP | -1176.06187035; Eh | |||
 | 1-Jun-2022 | K_don_c7_me | Laconsay, Croix | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | - | DEF2SVP | -1716.03383198; Eh | |||
 | 1-Jun-2022 | TS_J_K_acc_c7_me | Laconsay, Croix | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | - | DEF2SVP | -1637.46862312; Eh | |||
 | 1-Jun-2022 | TS_C_F_acc_c7_me | Laconsay, Croix | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | - | DEF2SVP | -1637.50870519; Eh |
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