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Item hits:
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | system_with_ascorbate_TS-a | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3538.0119238; Eh | ||
 | system_with_ascorbate_TS-b | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3538.0002228; Eh | ||
 | system_with_ascorbate_TS-c | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3537.9880703; Eh | ||
 | system_with_ascorbate_V-a | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3538.0762533; Eh | ||
 | system_with_ascorbate_V-a_radical | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3538.02797; Eh | ||
 | system_with_ascorbate_V-b | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3538.059158; Eh | ||
 | system_with_ascorbate_V-b_radical | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3538.0233184; Eh | ||
 | system_with_ascorbate_V-c | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3538.0519714; Eh | ||
 | system_with_ascorbate_V-c_radical | Miłaczewska, Anna | Gaussian; 09; ES64L-G09RevE.01 | UB3LYP | - | -3538.0068222; Eh |
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