Kopfgrafik Nano

Selected Publications

  • Alaghemandi M. E. Spohr (2011): Molecular dynamics investigation of the thermo-responsive polymer poly (N-isopropylacrylamide) (PNIPAAM) Macromol. Theory Simul. 20 0000.
  • Antoniak C. M.E. Gruner M. Spasova A.V. Trunova F.M. Römer  A. Warland B. Krumme K. Fauth P. Entel H. Wende (2011): A guideline for atomistic design and understanding of ultrahard nanomagnets Nature Commun. 2 528.
  • Böhm H. A. Emelianov A. V. Eremin C. Schulz H. Jander (2011): On the effect of molecular and chemically bonded hydrogen addition on carbon particle formation in C3O2 pyrolysis behind shock waves Combust. Flame in press.
  • Boese A.D. H. Forbert M. Masia A. Tekin D. Marx G. Jansen (2011): Constructing simple yet accurate potentials for describing the solvation of HCl/water clusters in bulk Helium and nanodroplets Phys. Chem. Chem. Phys. 13 14550.
  • Dybowski J.N. D. Heider D. Hoffmann (2010): Prediction of co-receptor usage of hiv-1 from genotype PLoS Comput Biol 6 (4) e1000743.
  • Klawonn A. O. Rheinbach (2010): Highly scalable parallel domain decomposition methods with an application to biomechanics  Z. Angew. Math. Mech. (ZAMM) 90 No. 1 5.
  • Kruis F. E. J. Wei T. van der Zwaag S. Haep (2011): Computational fluid dynamics based stochastic aerosol modeling: Combination of a cell-based weighted random walk method and a constant-number Monte-Carlo method for aerosol dynamics Chemical Engineering Science in press doi:10.1016/j.ces.2011.10.040.
  • Schröder J. D. Balzani D Brands (2011): Approximation of random microstructures by periodic statistically similar representative volume elements based on lineal-path functions Arch Appl Mech 81 975-997.
  • Stuehle S. D. Wendt H. Jakob W. Kowalczyk (2011): Numerical ­simulation of hemodynamics in the ascending aorta induced by ­different aortic cannulas Minimally Invasive Therapy & Allied ­Technologies 20 125.
  • Wu H. A. Stroppa S. Sakong S. Picozzi M. Scheffler P. Kratzer (2010): Magnetism in C or N-doped MgO and ZnO: Density functional study of impurity pairs Phys. Rev. Lett. 105 267203.