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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpegS2Katzenburg, FelixOrca; 5.0.3; RELEASEUKS; UKSdef2-SVP; def2-TZVPP-1771.54287793; -1773.30458081; Eh; Eh
thumbnail.jpegS2_tripKatzenburg, FelixOrca; 5.0.3; RELEASEUKS; UKSdef2-SVP; def2-TZVPP-1771.43179280; -1773.22028388; Eh; Eh
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