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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 22-Aug-2022 | /Me/triplet TS4_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | UPBE1PBE | DEF2SVP | -2761.64136001; Eh | |||
 | 22-Aug-2022 | /Me/triplet TS6_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | UPBE1PBE | DEF2SVP | -2761.70539239; Eh | |||
 | 22-Aug-2022 | /Me/triplet IM1_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UPBE1PBE | DEF2SVP | -2781.77941854; Eh | |||
 | 22-Aug-2022 | /Me/triplet IM4_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UPBE1PBE | DEF2SVP | -2324.35191923; Eh | |||
 | 22-Aug-2022 | /Me/triplet TS3_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | UPBE1PBE | DEF2SVP | -2761.62704054; Eh | |||
 | 22-Aug-2022 | /Me/triplet TS5_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | UPBE1PBE | DEF2SVP | -2761.66099049; Eh | |||
 | 22-Aug-2022 | /Me/triplet TS1_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization TS | UPBE1PBE | DEF2SVP | -2781.76739489; Eh | |||
 | 22-Aug-2022 | /Me/triplet IM6_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UPBE1PBE | DEF2SVP | -2761.70638901; Eh | |||
 | 22-Aug-2022 | /Me/triplet IM8_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UPBE1PBE | DEF2SVP | -2761.72289088; Eh | |||
 | 22-Aug-2022 | /Me/triplet IM7_triplet | Guo, Wentao | Gaussian; 16; ES64L-G16RevC.01 | Geometry optimization Minimum | UPBE1PBE | DEF2SVP | -2761.67504749; Eh |
Results 21-30 of 32 (Search time: 0.001 seconds).