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Item hits:
| Preview | Title | Author(s) | Program | Method(s) | Basis Set | Energy | Solv. | Vibr. |
|---|---|---|---|---|---|---|---|---|
 | F_TS5_1_2 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -4606.34165727; Eh | ||
 | F_TS5_1_1 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -4606.34822619; Eh | ||
 | TS1 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -2982.40748664; Eh | ||
 | TS2 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -3737.52068499; Eh | ||
 | TS3 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -3737.57285216; Eh | ||
 | TS4 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -3228.73183611; Eh | ||
 | TS5_1_1 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -3983.85002407; Eh | ||
 | TS5_1_2 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -3983.85551040; Eh | ||
 | TS6_1_1 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -3983.88291201; Eh | ||
 | TS6_1_2 | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevC.01 | RwB97XD | DEF2SVPP | -3983.87491793; Eh |
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