di Dio PJ, Brehm M, Kirchner B. Singular Value Decomposition for Analyzing Temperature- and Pressure-Dependent Radial Distribution Functions: Decomposition into Grund RDFs (GRDFs). J Chem Theory Comput. 2011;7 (10):3035-3039. doi:10.1021/ct2003385
LibreCat: /record/44961
DOI: 10.1021/ct2003385

Brüssel M, Brehm M, Voigt T, Kirchner B. Ab initio Molecular Dynamics Simulations of a Binary System of Ionic Liquids. Phys Chem Chem Phys. 2011;13:13617-13620. doi:10.1039/C1CP21550G
LibreCat: /record/44960
DOI: 10.1039/C1CP21550G

Brehm M, Kirchner B. TRAVIS – A Free Analyzer and Visualizer for Monte Carlo and Molecular Dynamics Trajectories. J Chem Inf Model. 2011;51 (8):2007-2023. doi:10.1021/ci200217w
LibreCat: /record/44958
DOI: 10.1021/ci200217w

Thar J, Brehm M, Seitsonen AP, Kirchner B. Unexpected Hydrogen Bond Dynamics in Imidazolium-Based Ionic Liquids. J Phys Chem B. 2009;113 (46):15129-15132. doi:10.1021/jp908110j
LibreCat: /record/44957
DOI: 10.1021/jp908110j