Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg22-Aug-2022/Orca H2von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1.16091378; Eh
thumbnail.jpeg22-Aug-2022/Orca RuBPY+von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1580.70574855; Eh
thumbnail.jpeg22-Aug-2022/Orca TS2oxvon Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1558.98010883; Eh
thumbnail.jpeg22-Aug-2022/Orca TS0von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1559.17077584; Eh
thumbnail.jpeg22-Aug-2022/Orca TS2von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1559.17491575; Eh
thumbnail.jpeg22-Aug-2022/Orca RuBPYPF6von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-3462.86457298; Eh
thumbnail.jpeg22-Aug-2022/Orca TS1oxvon Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1559.00296155; Eh
thumbnail.jpeg22-Aug-2022/Orca TS1von Wolff, NiklasOrca; 4.2.1; RELEASESingle pointRKSdef2-TZVPP; def2-tzvpp/c-1559.17699088; Eh
Results 21-28 of 28 (Search time: 0.001 seconds).

Discover

Program name
Calculation type