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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Oct-2021/lin/ox1 z_lin_c_23_1_001-001Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1025.8950304; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_t_23_2_011-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6320435; Eh
thumbnail.jpeg2-Oct-2021/lin/ox1 z_lin_t_22_1_010-010Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1025.8602745; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_t_24_2_101-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6298906; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_t_24_2_101-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6166963; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 z_lin_t_24_2_111-010Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6078192; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 z_lin_t_37_2_010-111Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6056105; Eh
thumbnail.jpeg2-Oct-2021/lin/ox1 s_lin_c_47_1_000-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1025.8951193; Eh
thumbnail.jpeg2-Oct-2021/lin/ox1 d_lin_t_22_1_100-001Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1025.8913724; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 z_lin_c_47_2_111-010Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6063173; Eh
Results 91-100 of 863 (Search time: 0.001 seconds).