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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Nov-2022DMA_C2_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.10476933; 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-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-2022phenyl_C4_33_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1721.97664986; Eh
thumbnail.jpeg22-Nov-2022SCH3_C2-C6_35_reactant_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-2365.72371185; Eh
thumbnail.jpeg22-Nov-2022DMA_C5_35_INT_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1625.07532577; Eh
thumbnail.jpeg22-Nov-2022SH_C2-C5_33_TS_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15DEF2SVP-2287.21440531; Eh
thumbnail.jpeg22-Nov-2022Parent_35_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-1491.41337613; Eh
thumbnail.jpeg22-Nov-2022OCH3_C4_33_product_MN15_def2-SVPAhmed, YusefGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15DEF2SVP-1605.71857374; Eh
Results 31-40 of 229 (Search time: 0.001 seconds).