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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_23_2_011-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6344945; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_23_2_101-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6464205; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_23_2_101-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.634827; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_23_2_101-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6245385; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_23_2_110-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6374077; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_23_2_110-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6248479; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_23_2_110-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6164691; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_011-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6524566; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_011-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6384556; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_011-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6265861; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_101-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6387155; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_101-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6263794; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_101-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6144673; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_110-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6287634; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_110-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6165519; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_24_2_110-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6067133; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_27_2_011-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6531126; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_27_2_011-101Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6361021; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_27_2_011-110Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6232946; Eh
thumbnail.jpeg2-Oct-2021/lin/ox2 s_lin_c_27_2_101-011Blancafort, LluísGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRCAM-B3LYP; TD-FC6-311G(D,P)-1024.6388249; Eh