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Item hits:
Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
---|---|---|---|---|---|---|---|---|
/template-3/int1 14_FFIAOA | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | DEF2TZVPP | -2498.1433152; Eh | |||
/sm template-2 | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | DEF2TZVPP | -2030.7784887; Eh | |||
/sm template-1 | Fernandez, Gilberto | Gaussian; 16; ES64L-G16RevA.03 | RMN15 | DEF2TZVPP | -1952.22174; Eh |
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