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| Preview | Issue Date | Title | Author(s) | Program | Calculation type | Method(s) | Basis Set | Energy | Solv. | Vibr. | Orb. |
|---|---|---|---|---|---|---|---|---|---|---|---|
 | 11-Mar-2018 | /PES_3df2p furan_TS21-22_3df2p | Alcami Pertejo, Manuel | Gaussian; 09; ES64L-G09RevD.01 | Geometry optimization TS | UB3LYP | - | -229.410121760; Eh | |||
 | 11-Mar-2018 | /PES_3df2p furan_TS22-f_3df2p | Alcami Pertejo, Manuel | Gaussian; 09; ES64L-G09RevD.01 | Geometry optimization TS | UB3LYP | - | -229.388480923; Eh | |||
 | 11-Mar-2018 | /PES_3df2p furan_TS19-20_3df2p | Alcami Pertejo, Manuel | Gaussian; 09; ES64L-G09RevD.01 | Geometry optimization TS | UB3LYP | - | -229.295034709; Eh | |||
 | 11-Mar-2018 | /PES_3df2p furan_TS23-24_3df2p | Alcami Pertejo, Manuel | Gaussian; 09; ES64L-G09RevD.01 | Geometry optimization TS | UB3LYP | - | -229.339255100; Eh | |||
 | 11-Mar-2018 | /PES_3df2p furan_TS20-21_3df2p | Alcami Pertejo, Manuel | Gaussian; 09; ES64L-G09RevD.01 | Geometry optimization TS | UB3LYP | - | -229.322149904; Eh | |||
 | 11-Mar-2018 | /PES_3df2p furan_TS24-f_3df2p | Alcami Pertejo, Manuel | Gaussian; 09; ES64L-G09RevD.01 | Geometry optimization TS | UB3LYP | - | -229.283654723; Eh | |||
 | 11-Mar-2018 | /PES_3df2p furan_TS20-f_3df2p | Alcami Pertejo, Manuel | Gaussian; 09; ES64L-G09RevD.01 | Geometry optimization TS | UB3LYP | - | -229.343078605; Eh | |||
 | 11-Mar-2018 | /PES_dp furan_TS19-20_dp | Alcami Pertejo, Manuel | Gaussian; 09; ES64L-G09RevD.01 | Geometry optimization TS | UB3LYP | - | -229.278917153; Eh | |||
 | 11-Mar-2018 | /PES_dp furan_TS24-f_dp | Alcami Pertejo, Manuel | Gaussian; 09; AM64L-G09RevC.01 | Geometry optimization TS | UB3LYP | - | -229.267391123; Eh | |||
 | 11-Mar-2018 | /PES_dp furan_TS23-24_dp | Alcami Pertejo, Manuel | Gaussian; 09; AM64L-G09RevC.01 | Geometry optimization TS | UB3LYP | - | -229.323071591; Eh |
Results 1-10 of 14 (Search time: 0.001 seconds).