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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required15-Nov-20219+von Wolff, NiklasGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumUM06LDEF2SVP DEF2SVP/W06-1503.68336797; Eh
Login required15-Nov-20213+von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1559.05955233; Eh
Login required15-Nov-20214von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1405.34968161; Eh
Login required15-Nov-20216von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1404.72799368; Eh
Login required15-Nov-20215von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1405.18241223; Eh
Login required15-Nov-2021EtOHvon Wolff, NiklasGaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRM06LDEF2SVP DEF2SVP/W06-154.903570378; Eh
Login required15-Nov-20211von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1865.03700367; Eh
Login required15-Nov-2021RuBPY+von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1580.70574855; Eh
Login required15-Nov-202111von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1848.00098464; Eh
Login required15-Nov-202110von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1848.48925462; Eh
Results 21-30 of 42 (Search time: 0.001 seconds).