Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Oct-2021/lin/ox2 d_lin_t_37_2_111-001Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6396772; Eh
thumbnail.jpeg2-Oct-2021/lin/ox3 d_lin_c_34_3_111-111Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1023.3820894; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_44_2_011-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.64627; Eh
thumbnail.jpeg2-Oct-2021/lin/ox1 z_lin_t_27_1_001-010Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1025.8612549; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 z_lin_t_37_2_111-010Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6044731; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 d_lin_c_34_2_111-010Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.637213; Eh
thumbnail.jpeg2-Oct-2021/cyc/ox1 z_cyc_23_43_1_010-100Blancafort, LluísGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6169499; Eh
thumbnail.jpeg2-Oct-2021/lin/ox1 s_lin_t_24_1_000-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1025.8868988; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_33_2_101-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6309309; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_t_24_2_101-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6435903; Eh
Results 51-60 of 780 (Search time: 0.001 seconds).