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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
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 TS2Mateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLanL2DZ; 6-311G**-1827.39268439; Eh
Login required21-Jun-2019/B2O4(C2H4)2 TS4CsO_BafterMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1289.45827704; Eh
Login required21-Jun-2019/B2O4(C2H4)2 Int3Ni_B_CCsMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-1289.45037701; 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 tetraB2Mateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-657.867856224; Eh
Login required21-Jun-2019/B2O4(C2H4)2 ProdMateo, AnnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYPLanL2DZ; 6-311G**-657.867856224; Eh
Login required30-Aug-2019TSadductMateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLANL2DZ 6-311G** GEN-1590.17720908; Eh
Login required30-Aug-2019TS1Mateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRB3LYPLANL2DZ 6-311G** GEN-1423.26370979; Eh
Login required30-Aug-2019phosphineMateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRB3LYP6-311G(D,P)-461.171818035; Eh
Results 11-20 of 96 (Search time: 0.001 seconds).