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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Oct-2022/template-3/ts2/iminol ts2_FBONIA_imidicacid_mpaaFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN DEF2TZVPP-3407.0012459; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/iminol 34_ddimidicacidFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.14035147; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/iminol 26_ddimidicacidFernandez, GilbertoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15GEN-3403.14358704; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 43_ts2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15036097; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 51_ts2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.14685564; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 20Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15075011; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 28Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.15256126; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 24Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3403.14949621; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-du 48Fernandez, GilbertoGaussian; 16; ES64L-G16RevC.01Geometry optimization TSRMN15GEN-3403.15860091; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/amide-dd ts2_FFONIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-3403.17169416; Eh
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