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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Nov-2022NH2_C2-C6_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1601.90375249; Eh
thumbnail.jpeg22-Nov-2022DMA_C7_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.11837702; Eh
thumbnail.jpeg22-Nov-2022OCH3_C2_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1605.72180885; Eh
thumbnail.jpeg22-Nov-2022NH2_C2-C6_35_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1601.93703111; Eh
thumbnail.jpeg22-Nov-2022DMA_C4_33_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.10566291; Eh
thumbnail.jpeg22-Nov-2022DMA_C4_33_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.09638221; Eh
thumbnail.jpeg22-Nov-2022SH_C2-C5_35_product_MN15_def2-SVPAhmed, YusefGaussian; 16; EM64M-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-2287.27781571; Eh
thumbnail.jpeg22-Nov-2022DMA_C1_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.07532577; Eh
thumbnail.jpeg22-Nov-2022phenyl_C4_33_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1721.94965715; Eh
thumbnail.jpeg22-Nov-2022NH2_C4_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1546.66086538; Eh
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