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Item hits:
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | a_alkoxide | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.88878912; Eh | ||
 | ts_to_a_alk | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.88329665; Eh | ||
 | b_alkoxide | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.88813471; Eh | ||
 | ts_to_b_alk | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.88302254; Eh | ||
 | am_alkoxide | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.89007616; Eh | ||
 | ts2_am_alk | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.88632158; Eh | ||
 | ts_h_migr_a_am | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.88716540; Eh | ||
 | b2_alk | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.87821618; Eh | ||
 | ts2_b2_alk | Garay Ruiz, Diego | Gaussian; 09; EM64L-G09RevD.01 | RB97D3 | 6-311G(D,P) | -3037.87713815; Eh |
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