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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg11-Mar-2018/PES_dp furan_MIN20_dpAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--229.380380476; Eh
thumbnail.jpeg11-Mar-2018/PES_3df2p furan_MIN21_3df2pAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--229.414338501; Eh
thumbnail.jpeg11-Mar-2018/PES_3df2p furan_MIN19_3df2pAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--229.404422518; Eh
thumbnail.jpeg11-Mar-2018/PES_3df2p furan_MIN24_3df2pAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--229.415850045; Eh
thumbnail.jpeg11-Mar-2018/PES_3df2p furan_MIN20_3df2pAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--229.396808732; Eh
thumbnail.jpeg11-Mar-2018/PES_3df2p furan_MIN22_3df2pAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--229.416562024; Eh
thumbnail.jpeg11-Mar-2018/PES_3df2p furan_MIN23_3df2pAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--229.403845909; Eh
thumbnail.jpeg11-Mar-2018/PES_dp furan_MIN19_dpAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--229.386953752; Eh
thumbnail.jpeg11-Mar-2018/PES_dp furan_MIN32_dpAlcami Pertejo, ManuelGaussian; 09; ES64L-G09RevD.01Geometry optimization MinimumUB3LYP--228.813303835; Eh
thumbnail.jpeg11-Mar-2018/PES_dp furan_MIN23_dpAlcami Pertejo, ManuelGaussian; 09; AM64L-G09RevC.01Geometry optimization MinimumUB3LYP--229.386161198; Eh
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