Browsing by Author Jesus, Jover

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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg18-Dec-2024/C_S HSPrJesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-517.408003331; Eh
thumbnail.jpeg24-Oct-2024/C_S HSPrJesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-517.408003331; Eh
thumbnail.jpeg24-Oct-2024/C_S HSPrJesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-517.408003331; Eh
thumbnail.jpeg18-Dec-2024/C_S I0Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3523.54566077; Eh
thumbnail.jpeg24-Oct-2024/C_S I0Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3523.54566077; Eh
thumbnail.jpeg24-Oct-2024/C_S I0Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3523.54566077; Eh
thumbnail.jpeg18-Dec-2024/C_S I1Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3535.99651227; Eh
thumbnail.jpeg24-Oct-2024/C_S I1Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3535.99651227; Eh
thumbnail.jpeg24-Oct-2024/C_S I1Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3535.99651227; Eh
thumbnail.jpeg18-Dec-2024/C_S I2Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3536.00434062; Eh
thumbnail.jpeg24-Oct-2024/C_S I2Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3536.00434062; Eh
thumbnail.jpeg24-Oct-2024/C_S I2Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3536.00434062; Eh
thumbnail.jpeg18-Dec-2024/C_S I3Jesus, JoverGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRB3LYPTZVP-4960.63875884; Eh
thumbnail.jpeg24-Oct-2024/C_S I3Jesus, JoverGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRB3LYPTZVP-4960.63875884; Eh
thumbnail.jpeg24-Oct-2024/C_S I3Jesus, JoverGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRB3LYPTZVP-4960.63875884; Eh
thumbnail.jpeg18-Dec-2024/C_S I4Jesus, JoverGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRB3LYPTZVP-4960.63774776; Eh
thumbnail.jpeg24-Oct-2024/C_S I4Jesus, JoverGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRB3LYPTZVP-4960.63774776; Eh
thumbnail.jpeg24-Oct-2024/C_S I4Jesus, JoverGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumRB3LYPTZVP-4960.63774776; Eh
thumbnail.jpeg18-Dec-2024/C_S I5Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3959.94344794; Eh
thumbnail.jpeg24-Oct-2024/C_S I5Jesus, JoverGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPTZVP-3959.94344794; Eh