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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Jun-2018cluster-B3LYP-4Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPSDD; 6-31G**; 6-31+G*-3839.93524076; Eh
thumbnail.jpeg27-Jun-2018cluster-B3LYP-2Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPSDD; 6-31G**; 6-31+G*-3839.91208792; Eh
thumbnail.jpeg12-Apr-2021TS_entLL2_freqJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureUB3LYPDEF2SVP-11056.6823961; Eh
thumbnail.jpeg12-Apr-2021TS_ent_LL1_freqJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureUB3LYPDEF2SVP-11056.6675045; Eh
thumbnail.jpeg12-Apr-2021TS_LL2_freqJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureUB3LYPDEF2SVP-11056.6848352; Eh
thumbnail.jpeg12-Apr-2021TS_LL1_freqJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureUB3LYPDEF2SVP-11056.6895516; Eh
thumbnail.jpeg12-Apr-2021TS_SL1_freqJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureUB3LYPDEF2SVP-10672.0470841; Eh
thumbnail.jpeg12-Apr-2021TS_SB1_freqJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureUB3LYPDEF2SVP-10672.0544300; Eh
thumbnail.jpeg12-Apr-2021TS_RL1_freqJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureUB3LYPDEF2SVP-10672.0531962; Eh
thumbnail.jpeg12-Apr-2021TS_RB1_freqJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Single point StructureUB3LYPDEF2SVP-10672.0491569; Eh
Results 1-10 of 74 (Search time: 0.002 seconds).