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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Nov-2022DMA_C2-C6_33_product_MN15_def2-QZVPP_gasAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2QZVPP-1760.67814934; Eh
thumbnail.jpeg22-Nov-2022DMA_C2_33_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-1625.09283294; Eh
thumbnail.jpeg22-Nov-2022phenyl_C4_35_TS2_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1721.93600917; Eh
thumbnail.jpeg22-Nov-2022DMA_C4_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.10085801; Eh
thumbnail.jpeg22-Nov-2022DMA_C2-C6_33_TS_MN15_def2-QZVPP_SMD_chloroformAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2QZVPP-1760.66469323; Eh
thumbnail.jpeg22-Nov-2022SCH3_C2-C6_33_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-2365.72122634; Eh
thumbnail.jpeg22-Nov-2022OCH3_C2_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1605.71362789; Eh
thumbnail.jpeg22-Nov-2022OH_C4_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1566.50854539; Eh
thumbnail.jpeg22-Nov-2022DMA_C5_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.07532577; Eh
thumbnail.jpeg22-Nov-2022DMA_C8_33_TS_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15DEF2SVP-1625.04814246; Eh
Results 21-30 of 706 (Search time: 0.001 seconds).