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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 19-Sep-2022 | /Indole_NBS TS1A | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -4055.19551241; Eh | |||
 | 19-Sep-2022 | /Indole_NBS TS1B | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -4055.17915621; Eh | |||
 | 19-Sep-2022 | /Indole_I2_dimer TS0B | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -2312.22052709; Eh | |||
 | 19-Sep-2022 | /Indole_I2_dimer TS2A | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -2312.23904620; Eh | |||
 | 19-Sep-2022 | /Indole_I2_dimer TS1B | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -2312.23104091; Eh | |||
 | 19-Sep-2022 | /Indole_I2_dimer TS1A | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -2312.21932724; Eh | |||
 | 19-Sep-2022 | /Benzofuran TS2A | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -4035.74913407; Eh | |||
 | 19-Sep-2022 | /Benzofuran TS1B | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -4035.74858563; Eh | |||
 | 19-Sep-2022 | /Thiophene TS3B_prime | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -4205.30373289; Eh | |||
 | 19-Sep-2022 | /Thiophene TS3B | Wang-Yeuk, Kong | Gaussian; 16; ES64L-G16RevA.03 | Geometry optimization TS | RM062X | DEF2SVP | -4205.30925089; Eh |
Results 21-30 of 41 (Search time: 0.001 seconds).