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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg2-Oct-2023/geo_opt 3m_prep_t1Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUM062X6-311+G(D,P)-1769.36892234; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3m_prep_s0Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-311+G(D,P)-1769.40251699; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3d_core_t1Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUM062X6-311+G(D,P)-798.966327834; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3h_prep_t1Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUM062X6-311+G(D,P)-1588.49692625; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3g_prep_t1Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUM062X6-311+G(D,P)-1476.24558390; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3f_prep_t1Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUM062X6-311+G(D,P)-1359.46867584; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3f_core_t1Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumUM062X6-311+G(D,P)-666.403807142; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3g_prep_s0Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-311+G(D,P)-1476.27903273; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3h_prep_s0Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-311+G(D,P)-1588.53059076; Eh
thumbnail.jpeg2-Oct-2023/geo_opt 3f_prep_s0Mayer, PéterGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRM062X6-311+G(D,P)-1359.50394928; Eh
Results 21-30 of 98 (Search time: 0.001 seconds).