Predictions of Physicochemical Properties of Ionic Liquids with DFT. - Karl Karu; Anton Ruzanov; Heigo Ers; Vladislav Ivanistsev; Isabel Lage-Estebanez; José Manuel García de la Vega (Comput., 2016)

The role of errors related to DFT methods in calculations involving ion pairs of ionic liquids. - Isabel Lage-Estebanez; Lourdes del Olmo; Rafael López; José Manuel García de la Vega (J. Comput. Chem., 2017)