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.jpeg15-Oct-2021/GeomOpt_PBEPBE M82Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-2349.928354; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M84Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-2349.9256184; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE trans-stilbeneOcchipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGEN-540.0389884; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE styreneOcchipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGEN-309.2508804; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M6Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-2437.4887132; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M7Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-2629.5328772; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M9Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-1978.2438665; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M11Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-1809.9207512; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M10Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-2001.4234198; Eh
thumbnail.jpeg15-Oct-2021/GeomOpt_PBEPBE M12Occhipinti, Giovanni; Foscato, Marco; Jensen, Vidar R.Gaussian; 16; ES64L-G16RevB.01Geometry optimization MinimumRHF; RPBEPBEGENECP GEN-2056.7299749; Eh
Results 51-60 of 85 (Search time: 0.001 seconds).

Discover

Subject
Method