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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg5-Jun-2022IM5-dashdashPrasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1630.81186082; Eh
thumbnail.jpeg5-Jun-2022IM5-dashPrasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1630.77894453; Eh
thumbnail.jpeg5-Jun-2022IM7Prasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1647.01245966; Eh
thumbnail.jpeg5-Jun-2022IM6Prasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1647.04746487; Eh
thumbnail.jpeg5-Jun-2022IM5Prasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1647.04496911; Eh
thumbnail.jpeg5-Jun-2022c4-productPrasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1146.55301935; Eh
thumbnail.jpeg5-Jun-2022IM3-dashPrasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-3956.55953910; Eh
thumbnail.jpeg5-Jun-2022IM2-dashdashPrasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1664.78270648; Eh
thumbnail.jpeg5-Jun-2022IM3-dashdashPrasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1435.76633647; Eh
thumbnail.jpeg5-Jun-2022IM2-dashPrasad, SupreethGaussian; 16; ES64L-G16RevA.03Geometry optimization MinimumRB3LYPDEF2SVP-1435.79022210; Eh
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