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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Oct-2022/template-2/int2 int2_FFOAIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN DEF2TZVPP-2863.0468804; Eh
thumbnail.jpeg5-Oct-2022/template-2/int2 int2_BFONIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2859.86445421; Eh
thumbnail.jpeg5-Oct-2022/template-2/int6 int6_BFINIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN DEF2TZVPP-3208.6235195; Eh
thumbnail.jpeg5-Oct-2022/template-2/int6 int6_FFONIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN DEF2TZVPP-3208.6210897; Eh
thumbnail.jpeg5-Oct-2022/template-2/int3 int3_BFINIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2859.89153161; Eh
thumbnail.jpeg5-Oct-2022/template-2/int4 int4_BFINIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-3205.00649009; Eh
thumbnail.jpeg5-Oct-2022/template-2/int2 int2_BFINIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-2859.86722639; Eh
thumbnail.jpeg5-Oct-2022/template-2/int5 int5_BFINIA_t2Fernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15GEN-3205.03380053; Eh
thumbnail.jpeg5-Oct-2022/sm template-3Fernandez, GilbertoGaussian; 16; ES64L-G16RevC.01Geometry optimization MinimumRMN15GEN-2226.63325764; Eh
thumbnail.jpeg5-Oct-2022/sm quinolineFernandez, GilbertoGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRMN15DEF2SVP-401.091642987; Eh
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