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Showing results 21 to 40 of 470 < previous   next >
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg28-Feb-2024Int6Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1296.65589565; Eh
thumbnail.jpeg28-Feb-2024Int6Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1200.40216494; Eh
thumbnail.jpeg28-Feb-2024Int7Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1296.69763757; Eh
thumbnail.jpeg28-Feb-2024Int7(1-B)Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1200.45354389; Eh
thumbnail.jpeg28-Feb-2024Int8Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1525.65778886; Eh
thumbnail.jpeg28-Feb-2024Int8Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1429.41450018; Eh
thumbnail.jpeg7-Apr-2024Int8_6-membersAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1234.22739127; Eh
thumbnail.jpeg28-Feb-2024Int9Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1525.65677313; Eh
thumbnail.jpeg28-Feb-2024Int9Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1429.41469209; Eh
thumbnail.jpeg28-Feb-2024Int9-REAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1333.15208719; Eh
thumbnail.jpeg28-Feb-2024Int9-RE_6-membersAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1137.96793684; Eh
thumbnail.jpeg28-Feb-2024Ketone_ProductAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-770.175099309; Eh
thumbnail.jpeg28-Feb-2024m_BrAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-3283.33485542; Eh
thumbnail.jpeg28-Feb-2024m_CF3Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1046.93420410; Eh
thumbnail.jpeg28-Feb-2024m_ClAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-1169.64356953; Eh
thumbnail.jpeg28-Feb-2024m_CNAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-802.353292792; Eh
thumbnail.jpeg28-Feb-2024m_FAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-809.330872855; Eh
thumbnail.jpeg28-Feb-2024m_MeAlves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-749.466190838; Eh
thumbnail.jpeg28-Feb-2024m_NH2Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-765.500575122; Eh
thumbnail.jpeg28-Feb-2024m_NO2Alves, ErickGaussian; 16; EM64L-G16RevC.01Geometry optimization MinimumRM06LDEF2SVP-914.522659192; Eh
Showing results 21 to 40 of 470 < previous   next >