Search        

Current filters:
Add filters:

Use filters to refine the search results.

  • previous
  • 1
  • next
Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg9-Sep-2016Acetic_acidPhung, QuanMolcas; 8.0Geometry optimizationDFTANO-S-
thumbnail.jpeg9-Sep-2016AcroleinPhung, QuanTURBOMOLE; 6.4Single point Excited stateDFTdef2-TZVP-191.8830116755; Eh
Results 1-2 of 2 (Search time: 0.001 seconds).