Publications

Sofia Kantorovich, Juan J. Cerdà, and Christian Holm. Microstructure analysis of monodisperse ferrofluid monolayers: theory and simulation. Phys. Chem. Chem. Phys., (10)14:1883-1895, The Royal Society of Chemistry, 2008. [PUMA: mpg icp crdf] URL

Jochen Schmidt, Christian Krekeler, Florian Dommert, Yuanyuan Zhao, Robert Berger, Luigi Delle Site, and Christian Holm. Ionic Charge Reduction and Atomic Partial Charges from First-Principles Calculations of 1,3-Dimethylimidazolium Chloride. The Journal of Physical Chemistry B, (114)18:6150--6155, American Chemical Society (ACS), April 2010. [PUMA: mpg csc icp dfg spp1191] URL

Florian Dommert, Katharina Wendler, Baofu Qiao, Luigi Delle Site, and Christian Holm. Generic force fields for ionic liquids. Journal of Molecular Liquids, (192):32--37, Elsevier BV, April 2014. [PUMA: mpg hlrs icp dfg spp1191] URL

Baofu Qiao, Christian Krekeler, Robert Berger, Luigi Delle Site, and Christian Holm. Effect of Anions on Static Orientational Correlations, Hydrogen Bonds, and Dynamics in Ionic Liquids:0.167em A Simulational Study. The Journal of Physical Chemistry B, (112)6:1743--1751, American Chemical Society (ACS), January 2008. [PUMA: mpg csc icp dfg] URL

Florian Dommert, Jochen Schmidt, Baofu Qiao, Yuanyuan Zhao, Christian Krekeler, Luigi Delle Site, Robert Berger, and Christian Holm. A comparative study of two classical force fields on statics and dynamics of EMIMBF4 investigated via molecular dynamics simulations. The Journal of Chemical Physics, (129)22AIP Publishing, December 2008. [PUMA: mpg csc icp dfg spp1191] URL