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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Nov-2022DMA_C6_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.08951023; Eh
thumbnail.jpeg22-Nov-2022NH2_C4_33_TS1_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1546.64134418; Eh
thumbnail.jpeg22-Nov-2022DMA_C2-C6_35_product_MN15_def2-QZVPP_SMD_chloroformAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2QZVPP-1760.73390431; Eh
thumbnail.jpeg22-Nov-2022phenyl_C4_33_TS2_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1721.94471181; Eh
thumbnail.jpeg22-Nov-2022DMA_C2-C5_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-1758.78021022; Eh
thumbnail.jpeg22-Nov-2022phenyl_C4_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1721.98304401; Eh
thumbnail.jpeg22-Nov-2022phenyl_C4_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1721.98673864; Eh
thumbnail.jpeg22-Nov-2022SCH3_C2_35_TS2_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1928.52103820; Eh
thumbnail.jpeg22-Nov-2022OCH3_C4_35_TS2_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1605.68015534; Eh
thumbnail.jpeg22-Nov-2022DMA_C1_33_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.08787489; Eh
Results 201-210 of 243 (Search time: 0.001 seconds).