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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg11-Sep-2020/Orca 13EXPvon Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-2246.11879486; Eh
thumbnail.jpeg11-Sep-2020/Orca 11EXPvon Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-2012.22675478; Eh
thumbnail.jpeg11-Sep-2020/Orca 8EXPvon Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-2015.83861163; Eh
thumbnail.jpeg11-Sep-2020/Orca 10von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1708.59633789; Eh
thumbnail.jpeg11-Sep-2020/Orca 13von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1634.47827451; Eh
thumbnail.jpeg11-Sep-2020/Orca 8von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1480.64257886; Eh
thumbnail.jpeg11-Sep-2020/Orca 9von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1709.73248751; Eh
thumbnail.jpeg11-Sep-2020/Orca 11von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1400.59340942; Eh
thumbnail.jpeg11-Sep-2020/Orca 12von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1405.33516951; Eh
thumbnail.jpeg11-Sep-2020/Orca 4EXPvon Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-2017.00151662; Eh
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