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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Nov-2022DMA_C2-C6_35_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1758.81468393; Eh
thumbnail.jpeg22-Nov-2022OCH3_C2-C5_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1720.02202077; Eh
thumbnail.jpeg22-Nov-2022NH2_C2-C5_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1601.88915929; Eh
thumbnail.jpeg22-Nov-2022OCH3_C2_35_TS1_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1605.67899505; Eh
thumbnail.jpeg22-Nov-2022OCH3_C4_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1605.72312281; Eh
thumbnail.jpeg22-Nov-2022DMA_C1_35_TS1_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1625.03998622; Eh
thumbnail.jpeg22-Nov-2022DMA_C5_35_TS2_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1625.03998622; Eh
thumbnail.jpeg22-Nov-2022DMA_C2-C6_35_reactant_MN15_def2-QZVPP_gasAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2QZVPP-1760.67104108; Eh
thumbnail.jpeg22-Nov-2022NH2_C2-C5_35_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1601.91788159; Eh
thumbnail.jpeg22-Nov-2022DMA_C3_35_TS2_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1625.03359591; Eh
Results 61-70 of 229 (Search time: 0.001 seconds).