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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Oct-2022/template-3/int4 int4_BFINIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-3403.17354645; Eh
thumbnail.jpeg5-Oct-2022/template-3/mono_HFIP int1_BFONON_HFIPFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-3283.78806615; Eh
thumbnail.jpeg5-Oct-2022/template-2/ts1_t2/c4 ts1c4_FFONIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN DEF2TZVPP-2863.0350852; Eh
thumbnail.jpeg5-Oct-2022/template-2/int1 10_FFIAINFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2297.09672127; Eh
thumbnail.jpeg5-Oct-2022/template-2/int1 5_BBINIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2297.10234676; Eh
thumbnail.jpeg5-Oct-2022/template-2/int1 7_BFONIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2297.09417351; Eh
thumbnail.jpeg5-Oct-2022/template-2/int1 6_FFONIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2297.09573829; Eh
thumbnail.jpeg5-Oct-2022/template-2/int1 9_FBINIAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2297.09893000; Eh
thumbnail.jpeg5-Oct-2022/template-2/int1 12_BBOAOAFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2297.08729682; Eh
thumbnail.jpeg5-Oct-2022/template-2/int2 int2_FFONIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN DEF2TZVPP-2863.0493906; Eh
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