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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Oct-2022/template-3/ts1/c4 61_FFIAIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-3058.02155313; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts1/c4 ts1c4_FBIAINFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3058.02296585; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts1/c4 ts1c4_BBINIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3058.02228157; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts1/c4 ts1c4_FBONINFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3058.01566163; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts1/c2 ts1c2_FBONINFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RMN153-21G GEN-3058.01943196; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts1/c2 ts1c2_FFONINFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYP; RMN153-21G GEN-3058.01517688; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts1/c3 ts1c3_BFINIA_t3Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3058.02382865; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts1/c3 ts1c3_FBININFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3058.02135282; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts1/c3 ts1c3_BFOAIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3058.01830870; Eh
thumbnail.jpeg5-Oct-2022/template-3/ts2/OAc 1_ts2_oacFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization TSRMN15GEN-3195.54315370; Eh
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