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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 31_du_mpaaFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.14947830; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 40_ts2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15256127; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 45Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.14996914; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-dd 66Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15538133; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 50Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15602991; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-dd 54Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15627484; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-dd 79Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15806510; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-dd 47Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15911137; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-dd ts2_FBONIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15955392; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-dd ts2_FFINIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.16208432; Eh
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