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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 5-Oct-2022 | /template-3/ts3 ts3_FBONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RMN15 | DEF2SVP GEN | -3403.15823263; Eh | |||
 | 5-Oct-2022 | /template-3/ts4 ts4_BFINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RMN15 | GEN | -3403.14619510; Eh | |||
 | 5-Oct-2022 | /template-3/ts3 ts3_BFINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RMN15 | GEN | -3403.16565749; Eh | |||
 | 5-Oct-2022 | /template-3/ts3 ts3_FFINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RMN15 | GEN | -3403.16122621; Eh | |||
 | 5-Oct-2022 | /template-3/ts4 ts4_FBONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RMN15 | GEN | -3403.14096255; Eh | |||
 | 5-Oct-2022 | /template-3/ts4 ts4_FFINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RMN15 | GEN | -3403.14206287; Eh | |||
 | 5-Oct-2022 | /template-3/ts4 IRC_reverse_FBONIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | - | - | -3403.15896107; Eh | |||
 | 5-Oct-2022 | /template-3/ts4 IRC_reverse_FFINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | - | - | -3403.15896107; Eh | |||
 | 5-Oct-2022 | /template-3/ts4 IRC_forward_FFINIA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Single point Structure | - | - | -3403.20024267; Eh | |||
 | 5-Oct-2022 | /template-3/int1 1_BFONON | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization Minimum | RMN15 | GEN | -2495.25667514; Eh |
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- 285 C-H activation