Browsing by Subject Host-guest systems

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Showing results 1 to 10 of 10
PreviewIssue DateTitleAuthor(s)ProgramCalculation typeMethod(s)Basis SetEnergySolv.Vibr.Orb.
thumbnail.jpeg13-Sep-2019Calix5OMeLledó, AgustíGaussian; 09; ES64L-G09RevE.01Single point StructureRB3LYP--
thumbnail.jpeg13-Sep-2019Calix5OMe_coroneneLledó, AgustíGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYP--
thumbnail.jpeg13-Sep-2019Calix5OMe_peryleneLledó, AgustíGaussian; 16; ES64L-G16RevA.03Single point StructureRB3LYP--
Login required1-Feb-2019gaussian01Lledó, AgustíGaussian; 09; ES64L-G09RevE.01Single point StructureUB3LYP--
thumbnail.jpeg10-Feb-2019I1__AdCNLledó, AgustíGaussian; 09; ES64L-G09RevE.01Single point StructureRPM6--
thumbnail.jpeg10-Feb-2019I2_AdCNLledó, AgustíGaussian; 09; ES64L-G09RevE.01Single point StructureRPM6--
thumbnail.jpeg10-Feb-2019I3_AdCNLledó, AgustíGaussian; 09; ES64L-G09RevE.01Single point StructureRPM6--
thumbnail.jpeg10-Feb-2019I4_AdCNLledó, AgustíGaussian; 09; ES64L-G09RevE.01Single point StructureRPM6--
thumbnail.jpeg10-Feb-2019K_AdCNLledó, AgustíGaussian; 09; ES64L-G09RevE.01Single point StructureRPM6--
thumbnail.jpeg10-Feb-2019V_AdCNLledó, AgustíGaussian; 09; ES64L-G09RevE.01Single point StructureRPM6--