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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg21-Nov-2022Parent_3_3_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-1491.40281362; Eh
thumbnail.jpeg21-Nov-2022phenyl_C4_3_3_TS2_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1721.94471181; Eh
thumbnail.jpeg21-Nov-2022DMA_C2-C6_3_5_INT_MN15_def2-QZVPP_gasAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2QZVPP-1760.66879222; Eh
thumbnail.jpeg21-Nov-2022CH3_C4_3_3_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1530.63579718; Eh
thumbnail.jpeg21-Nov-2022DMA_C3_3_5_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.09801611; Eh
thumbnail.jpeg21-Nov-2022phenyl_C4_3_5_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1721.98673864; Eh
thumbnail.jpeg21-Nov-2022Parent_3_5_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-1491.40274221; Eh
thumbnail.jpeg21-Nov-2022Parent_3_3_product_MN15_def2-SVP_SMDAhmed, YusefGaussian; 16; EM64M-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-1491.42934210; Eh
thumbnail.jpeg21-Nov-2022DMA_C2_3_5_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.10476933; Eh
thumbnail.jpeg21-Nov-2022SCH3_C2-C6_3_5_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-2365.72701642; Eh
Results 31-40 of 141 (Search time: 0.0 seconds).