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 tetraBMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-311G**-637.995651822; Eh
Login required21-Jun-2019/B2O4(C2H4)2 ProductMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-311G**-484.626076741; Eh
Login required21-Jun-2019/B2O4(C2H4)2 ReactMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-311G**-383.786142203; Eh
Login required21-Jun-2019/B2O4(C2H4)2 After_TS2Mateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1827.40096556; Eh
Login required21-Jun-2019/B2O4(C2H4)2 Int2-Ni-OMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1289.37938943; Eh
Login required21-Jun-2019/B2O4(C2H4)2 Int3_Ni_B_CMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1269.55460524; Eh
Login required21-Jun-2019/B2O4(C2H4)2 Int2-Ni-B2Mateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1269.55678018; Eh
Login required21-Jun-2019/B2O4(C2H4)2 Int1-Niiso2Mateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1015.36798111; Eh
Results 31-38 of 38 (Search time: 0.002 seconds).