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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
Login required30-Jan-2019/Solv_Opt/wB97XD/Reactants/CO2 CO2González Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD--188.572293711; Eh
Login required30-Jan-2019/Solv_Opt/wB97XD/CC CCGonzález Fabra, JoanGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XD--499.656947261; Eh
Login required21-Jun-2019/wB97X-D ProductMateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XDLanL2DZ; 6-311G**-814.925707071; Eh
Login required21-Jun-2019/wB97X-D TS2-modelMateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization TSRwB97XDLanL2DZ; 6-311G**-2141.37418765; Eh
Login required21-Jun-2019/wB97X-D PrevNMateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XDLanL2DZ; 6-311G**-1693.11443553; Eh
Login required21-Jun-2019/wB97X-D PrevMateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XDLanL2DZ; 6-311G**-1712.95522393; Eh
Login required21-Jun-2019/wB97X-D Prev-modelMateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XDLanL2DZ; 6-311G**-1014.99698831; Eh
Login required21-Jun-2019/wB97X-D Prev2-modelMateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XDLanL2DZ; 6-311G**-1015.03183296; Eh
Login required21-Jun-2019/wB97X-D CsBCO3Mateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XDLanL2DZ; 6-311G**-695.086000714; Eh
Login required21-Jun-2019/wB97X-D Cat_Mateo, AnaGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumRwB97XDLanL2DZ; 6-311G**-1329.27629743; Eh
Results 731-740 of 783 (Search time: 0.002 seconds).