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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg27-Jun-2018cluster-B3LYP-2Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPSDD; 6-31G**; 6-31+G*-3839.91208792; Eh
thumbnail.jpeg27-Jun-2018cluster-M06-L-2Ortuño, ManuelGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM06LSDD; 6-31G**; 6-31+G*-3839.62044252; Eh
thumbnail.jpeg21-Jul-2020Styrene_oxideJover Modrego, JesúsGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SVP-384.589922332; Eh
thumbnail.jpeg21-Jul-2020TAMOFJover Modrego, JesúsGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SVP-10000.0130099; Eh
thumbnail.jpeg21-Jul-2020RL1_productJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SVP-672.062139633; Eh
thumbnail.jpeg21-Jul-2020I-RJover Modrego, JesúsGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SVP-10384.6447492; Eh
thumbnail.jpeg21-Jul-2020I-SJover Modrego, JesúsGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SVP-10384.6434197; Eh
thumbnail.jpeg21-Jul-2020LL2_productJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SVP-1056.70133348; Eh
thumbnail.jpeg21-Jul-2020LL1_productJover Modrego, JesúsGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYPDEF2SVP-1056.70105418; Eh
thumbnail.jpeg6-Nov-2020/Cluster-Fe-MOF-74 M06-L-OOHMorales-Vidal, JordiGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUM06LSDD 6-31G** 6-31+G* GEN-3156.68594456; Eh
Results 31-40 of 387 (Search time: 0.001 seconds).