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PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg19-Apr-2018TS21-22sFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-951.642517606; Eh
thumbnail.jpeg19-Apr-2018TS23p-15pFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-1070.19583429; Eh
thumbnail.jpeg19-Apr-2018TS23-15Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-1070.19969069; Eh
thumbnail.jpeg19-Apr-201815AgFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-1819.28779144; Eh
thumbnail.jpeg19-Apr-2018PhenylPropyneFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-347.551671769; Eh
thumbnail.jpeg19-Apr-201816Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-1070.25883727; Eh
thumbnail.jpeg19-Apr-201815Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-1070.23762222; Eh
thumbnail.jpeg19-Apr-201825Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-1229.30822204; Eh
thumbnail.jpeg19-Apr-2018CO2Funes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Single point StructureRB97D6-311++G**-188.537554008; Eh
thumbnail.jpeg19-Apr-201812-CuII-CuIIFunes-Ardoiz, IgnacioGaussian; 09; EM64L-G09RevD.01Geometry optimization MinimumUB97DLANL2DZ; 6-31G*-2690.18282585; Eh
Results 41-50 of 63 (Search time: 0.001 seconds).