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.jpeg30-Aug-2018IX1Besora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d); sdd-1098.50417907; Eh
thumbnail.jpeg30-Aug-2018IX2Besora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d); sdd-1174.94568574; Eh
thumbnail.jpeg30-Aug-2018nitrophenylazideBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d)-600.388598025; Eh
thumbnail.jpeg30-Aug-2018phenylazideBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d)-395.857319138; Eh
thumbnail.jpeg30-Aug-2018N2Besora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d)-109.523780034; Eh
thumbnail.jpeg30-Aug-2018TolueneBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d)-271.558127933; Eh
thumbnail.jpeg30-Aug-2018VIII_singletBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d); sdd-1386.13884354; Eh
thumbnail.jpeg30-Aug-2018newTSsqplanarNO2Besora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d); sdd-1352.11863773; Eh
thumbnail.jpeg30-Aug-2018nitrophenylazideBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d)-600.388598025; Eh
thumbnail.jpeg30-Aug-2018PhCOHBesora, MariaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRBP866-31g(d)-345.574589447; Eh
Results 1-10 of 22 (Search time: 0.0 seconds).

Discover

Program name