Search        

Current filters:
Add filters:

Use filters to refine the search results.

Item hits:
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required21-Jun-2019/B2O4(C2H4)2 TS3CsB-CMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1289.41671489; Eh
Login required21-Jun-2019/B2O4(C2H4)2 TS4CsB-OMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1289.42429991; Eh
Login required21-Jun-2019/B2O4(C2H4)2 TS4CsO_BMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1289.42818600; Eh
Login required21-Jun-2019/B2O4(C2H4)2 TS3B-CMateo, AnnaGaussian; 09; EM64L-G09RevD.01Single point StructureRB3LYPLanL2DZ; 6-311G**-1289.39148544; Eh
Login required21-Jun-2019/B2O4(C2H4)2 tetraB2Mateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-657.867856224; Eh
Login required21-Jun-2019/B2O4(C2H4)2 TS2Mateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1827.39268439; Eh
Login required21-Jun-2019/B2O4(C2H4)2 ProdMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-657.867856224; Eh
Login required21-Jun-2019/B2O4(C2H4)2 CatMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-631.524752920; Eh
Login required21-Jun-2019/B2O4(C2H4)2 Int2-Ni-BMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1269.54295142; Eh
Login required21-Jun-2019/B2O4(C2H4)2 Int1-NiMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1015.39415308; Eh
Results 11-20 of 38 (Search time: 0.001 seconds).