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Klima (8)

König, M., R. Wolke, et al. (2012). Modelling of Atmospheric Processes. NIC Symposium 2012, pp. 313-320. K. Binder, G. Münster and M. Kremer. Jülich.

Kurzmann, A. (2012). Applications of 2D and 3D full waveform tomography in acoustic and viscoacoustic complex media, Karlsruhe Institute of Technology. Ph. D. thesis.

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Mellado, J. P. and C. Ansorge (2012). Direct numerical simulation of turbulent mixing in the planetary boundary layer. NIC Symposium 2012, pp. 295-312. K. Binder, G. Münster and M. Kremer. Jülich.

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Spiekermann, G. (2012). Structure and properties of SiO2-bearing aqueous fluids and glasses from first-principles modeling, FU Berlin. Ph. D. thesis.

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Kondensierte Materie (25)

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Bürzle, F. (2012). Numerical studies in star formation using smoothed particle hydrodynamics, Universität Konstanz. Ph. D. thesis.

Deb, D., D. Wilms, et al. (2012). Monte carlo studies of interfacial free energies in colloidal suspensions. NIC Symposium 2012 Proceedings, p. 235. K. Binder, G. Münster and M. Kremer. Jülich.

Frijters, S., F. Günther, et al. (2012). "Effects of nanoparticles and surfactant on droplets in shear flow " Soft Matter 8(24): 6542 - 6556.

Goth, F. and F. F. Assaad (2012). "Time and spatially resolved quench of the fermionic Hubbard model showing restricted equilibration." Phys. Rev. B 85: 085129.

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Marelli, G. (2012). Minimal models for lipid membranes: local modifications around fusion objects, Universität Göttingen. Ph. D.

Mutter, D. (2012). Computersimulationen zu strukturellen Phasenübergängen und Formgedächtnisverhalten auf Nanometerskala, Universität Konstanz. Ph. D. thesis.

Neder, J., P. Nielaba, et al. (2012). "Interactions of membranes with coarse-grain proteins: a comparison." New Journal of Physics 14: 125017.

Perlekar, P., L. Biferale, et al. (2012). "Droplet size distribution in homogeneous isotropic turbulence." Physics of Fluids 24: 065101.

Raczkowski, M. and F. F. Assaad (2012). "Dimensional-crossover-driven Mott transition in the frustrated Hubbard model." Phys. Rev. Lett. 109: 126404.

Sarkar, A., A. N. Salazar, et al. (2012). "Quantification of the performance of chaotic micromixers on the basis of finite time Lyapunov exponents " Microfluidics and Nanofluidics 13(1): 19-27.

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Tretyakov, N. (2012). Molecular Dynamics simulations of polymer liquids on substrates of different topography, Unibersität Göttingen. Ph. D.

Weeber, R. and J. Harting (2012). "Hydrodynamic interactions in active colloidal crystal microrheology." Physical Review E 86(5): 057302.

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Materialwissenschaft (25)

Dannenberg, A. (2012). Ab initio and Monte Carlo investigations of structural, electronic and magnetic properties of new ferromagnetic Heusler alloys with high Curie temperatures, Universität Essen. Ph. D. thesis.

Grieger, D., C. Piefke, et al. (2012). "Approaching finite-temperature phase diagrams of strongly correlated materials: A case study for V2O3." Phys. Rev. B 86: 155121.

Grünebohm, A., M. E. Gruner, et al. (2012). "Domain structure in the tetragonal phase of BaTiO3–from bulk to nanoparticles." Ferroelectrics 426(1): 21-30.

Grünebohm, A., A. Hucht, et al. (2012). Simulation of cluster sintering, dipolar chain formation and ferroelectric nanoparticulate systems. Nanoparticles from the Gasphase: formation – Structure – Properties, p. 139. A. Lorke, M. Winterer, R. Schmechel and C. Schulz, Springer.

Grünebohm, A., M. Siewert, et al. (2012). "First-principles study of the influence of (110) strain on the ferroelectric trends of TiO2." Ferroelectrics 429: 31.

Gruner, M. E. and P. Entel (2012). "Competition between ordering, twinning, and segregation in binary magnetic 3d-5d nanoparticles: A supercomputing perspective." International Journal of Quantum Chemistry 112: 277.

Gruner, M. E., S. Hamann, et al. (2012). "Compositional trends and magnetic excitations in binary and ternary Fe-Pd-X magnetic shape memory alloys." Journal of Alloys and Compounds doi:10.1016/j.jallcom.2012.02.033.

Jiang, D. and M. Walter (2012). "The halogen analogs of thiolated gold nanoclusters." Nanoscale 4: 4234-4239.

Kauffmann-Weiss, S., S. Hamann, et al. (2012). " Understanding the Magnetic Shape Memory System Fe–Pd–X by Thin Film Experiments and First-Principles Calculations." Advanced Engineering Materials 14: 724–749.

Kauffmann-Weiss, S., S. Hamann, et al. (2012). "Enhancing magnetocrystalline anisotropy of the Fe70Pd30 magnetic shape memory alloy by adding Cu." Acta Materialia 60: 6920.

Lippert, G., J. Dabrowski, et al. (2012). "Molecular Beam Epitaxy of Graphene on Mica." Phys. stat. sol. (b) 249(12): 2507–2510.

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Mehr, W., J. Dabrowski, et al. (2012). "Vertical Graphene Base Transistor." IEEE Electron Device Letter 33: 691.

Moseler, M., M. Walter, et al. (2012). "Oxidation State and Symmetry of Magnesia-Supported Pd13Ox Nanocatalysts Influence Activation Barriers of CO Oxidation." J. Am. Chem. Soc. 134: 7690–7699.

Niemann, R., U. K. Rößler, et al. (2012). "The Role of Adaptive Martensite in Magnetic Shape Memory Alloys." Advanced Engineering Materials 14: 562–581.

Pastewka, L., M. Mrovec, et al. (2012). "Bond order potentials for fracture, wear, and plasticity." MRS Bulletin 37: 493.

Pastewka, L., T. A. Sharp, et al. (2012). "Seamless elastic boundaries for atomistic calculations." Phys. Rev. B 86: 075459.

Sahoo, S. (2012). Ab initio study of free and deposited transition metal clusters, Universität Essen. Ph. D. thesis.

Sahoo, S., M. E. Gruner, et al. (2012). Nucleation, Structure and Magnetism of Transition Metal Clusters from First Principles. Nanoparticles from the Gasphase: Formation – Structure – Properties, p. 77. A. Lorke, M. Winterer, R. Schmechel and C. Schulz. Heidelberg, Springer.

Schäfer, J. and K. Albe (2012). "Influence of solutes on the competition between mesoscopic grain boundary sliding and coupled grain boundary motion." Scripta Materialia 66(5): 315-317.

Seino, K., F. Bechstedt, et al. (2012). "Influence of separation of Si nanocrystals embedded in a SiO2 matrix on electronic and optical properties." Materials Science & Engineering B 177: 1098-1102.

Seino, K., P. Kroll, et al. (2012). "Tunneling of electrons between Si nanocrystals embedded in a SiO2 matrix." Phys. Rev. B 85: 075312.

Tarnawska, L. (2012). Novel oxide buffer approach for GaN integration on Si(111) platform through Sc2O3/Y2O3 bi-layer, Technische Universität Cottbus. Ph. D.

Zacherle, T. (2012). Ab initio Rechnungen zu Defekten in Galliumoxid. Darmstadt, TU Darmstadt. Ph.D.

Zoellner, M. H., J. Dabrowski, et al. (2012). "Stacking behavior of twin-free, type-B oriented CeO2(111) films on hexagonal-Pr2O3(0001)/Si(111) systems." Phys. Rev. B 85: 035302

Plasmaphysik (9)

Bitane, R., H. Homann, et al. (2012). "Time scales of turbulent relative dispersion." Phys. Rev E 86: 045302.

Grauer, R., H. Homann, et al. (2012). "Longitudinal and Transverse structure functions in high Reynolds-number turbulence." New Journal of Physics 14: 63016.

Liseykina, T. and D. Bauer (2012). Plasma Formation and Ionization Dynamics in Intense Laser-Droplet Interaction. NIC Symposium 2012, pp. 387-394. K. Binder, G. Münster and M. Kremer. Jülich.

Mehrling, T., J. Grebenyuk, et al. (2012). "Transverse emittance growth in staged laser-wakefield acceleration." Phys. Rev. ST Accel. Beams 15: 111303.

Sarri, G., A. Macchi, et al. (2012). "Dynamics of Self-Generated, Large Amplitude Magnetic Fields Following High-Intensity Laser Matter Interaction." Phys. Rev. Lett. 109: 205002.

Sperling, P., T. Liseykina, et al. (2012). Thomson Scattering on Inhomogeneous Targets. NIC Symposium 2012, pp. 395-400. K. Binder, G. Münster and M. Kremer. Jülich.

Vieira, J., R. A. Fonseca, et al. (2012). "Ion motion in self-modulated plasma wakefield accelerators." Phys. Rev. Lett. 109: 145005.

Vieira, J., J. L. Martins, et al. (2012). "Magnetically assisted self-injection and radiation generation for plasma-based acceleration." Plasma Phys. Control. Fusion 54: 124044.

Vranic, M., J. L. Martins, et al. (2012). "All-optical radiation reaction configuration at 1021 W/cm2." Nature Photonics submitted.

Polymere (18)

Chappa, V. C., D. C. Morse, et al. (2012). "Translationally Invariant Slip-Spring Model for Entangled Polymer Dynamics." Phys. Rev. Lett. 109: 148302.

Harrer, C., D. Winter, et al. (2012). "Force-induced diffusion in microrheology." J. Phys.: Condens. Matter 24: 464105.

Hömberg, M. and M. Müller (2012). "The role of inertia and coarse-graining on the transverse modes of lipid bilayers." EPL 97: 68010.

Hsu, H.-P. and K. Binder (2012). "Stretching semiflexible polymer chains: Evidence for the importance of excluded volume effects from Monte Carlo simulation." J. Chem. Phys. 136: 024901.

Hsu, H.-P., W. Paul, et al. (2012). "Scattering function of semiflexible polymer chains under good solvent conditions " J. Chem. Phys. 137: 174902.

Leroy, F. and F. Müller-Plathe (2012). "Can Continuum Thermodynamics Characterize Wenzel Wetting States of Water at the Nanometer Scale." Journal of Chemical Theory and Computation 8(10): 3724–3732.

LoVerso, F., S. A. Egorov, et al. (2012). "Interaction Between Polymer Brush-Coated Spherical Nanoparticles: Effect of Solvent Quality." Macromolecules 45: 8892.

LoVerso, F., L. Yelash, et al. (2012). "Effect of the solvent quality on the structural rearrangement of spherical brushes: coarse-grained models." Soft Matter 8: 4185-4196.

Mammen, L., X. Deng, et al. (2012). "Effect of Nanoroughness on Highly Hydrophobic and Superhydrophobic Coatings." Langmuir 28: 15005-15014.

Möddel, M., W. Janke, et al. (2012). Grafted and Non-Grafted Polymer Adsorption. NIC Symposium 2012, Jülich.

Müller, M. (2012). "Geometry-Controlled Interface Localization-Delocalization Transition in Block Copolymers." Phys. Rev. Lett. 109: 087801.

Müller, M., Y. G. Smirnova, et al. (2012). "Transition Path from Two Apposed Membranes to a Stalk Obtained by a Combination of Particle Simulations and String Method." Phys. Rev. Lett. 108: 228103.

Reith, D., K. Bucior, et al. (2012). "Spinodal decomposition of polymer solutions: Molecular Dynamics simulations of the two-dimensional case." J. Phys.: Cond. Mat. 24: 115102.

Steinmüller, B., M. Müller, et al. (2012). "Random Block Copolymers: Structure, Dynamics, and Mechanical Properties in the Bulk and at Selective Substrates." Macromolecules 45: 9841−9853.

Steinmüller, B., M. Müller, et al. (2012). "Properties of random block copolymer morphologies: Molecular dynamics and Singe-Chain-in-Mean-Field simulations." Macromolecules 45: 1107.

Winter, D. (2012). Computer simulations of slowly relaxing systems in external fields, Universität Mainz. Ph. D: thesis.

Winter, D., J. Horbach, et al. (2012). "Active non-linear micro-rheology in a glassforming Yukawa fluid." Phys. Rev. Lett. 108: 028303.

Yelash, L., P. Virnau, et al. (2012). "Three-step decay of time correlations at polymer-solid interfaces." Europhys. Lett. 98: 28006.

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Forssén, C., R. Roth, et al. (2012). "Systematics of 2+ states in C isotopes from the no-core shell model." Journal of Physics G: Nuclear and Particle Physics 40(5): 055105.

Petri, M., S. Paschalis, et al. (2012). "Structure of 16C: Testing shell model and ab initio approaches." Phys. Rev. C 86: 044329.

Quaglioni, S., P. Navrátil, et al. (2012). No-Core Shell Model Analysis of Light Nuclei. Proceedings of the 20th International IUPAP Conference on Few-Body Problems in Physics. Fukuoka, Japan.

Quaglioni, S., P. Navrátil, et al. (2012). "From nucleons to nuclei to fusion reactions." J. Phys.: Conf. Ser. 402: 012037.

Roth, R., S. Binder, et al. (2012). "Medium-Mass Nuclei with Normal-Ordered Chiral NN+3N Interactions." Phys. Rev. Lett. 109: 052501.

Roth, R., J. Langhammer, et al. (2012). New Horizons in Ab Initio Nuclear Structure Theory Proceedings of the Conference on Horizons of Innovative Theories, Experiments, and Supercomputing in Nuclear Physics (HITES 2012). New Orleans, USA, J. Phys.: Conf. Ser. 403, 012020

Roth, R., J. Langhammer, et al. (2012). Ab Initio Nuclear Structure Theory with Chiral NN+3N Interactions Proceedings of the YKIS2011 Symposium on Frontier Issues in Physics of Exotic Nuclei,. Kyoto, Japan, Prog. Theor. Phys. Suppl. 196, 131

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Strömungsforschung (23)

Bitane, R., J. Bec, et al. (2012). "Time scales of turbulent relative dispersion " Phys. Rev. E 86: 045302.

Chillà, F. and J. Schumacher (2012). "New perspectives in turbulent Rayleigh-Bénard convection." Eur. Phys. J. E 35: 58.

DANEYKO, A., D. HLUSHKOU, et al. (2012). "From random sphere packings to regular pillar arrays: Analysis of transverse dispersion." J. Chromatography A 1257: 98–115.

Dong, S., D. Krasnov, et al. (2012). "Secondary energy growth and turbulence suppression in conducting channel flow with streamwise magnetic field." Physics of Fluids 24: 074101.

E. Ivanova, B. N., P. Griebel, M. Aigner, and K. Syed (2012). "Numerical simulations of turbulent mixing and autoignition of hydrogen fuel at reheat combustor operating conditions." Transactions of the ASME 134: 041504.

Emran, M. S. and J. Schumacher (2012). Conditional statistics of thermal dissipation rate in turbulent Rayleigh-Benard convection. Eur. J. Phys. E. 35: 108.

Fiolitakis, A., P. R. Ess, et al. (2012). Transported PDF Calculations of a Turbulent, Non-Premixed, Non-Piloted, Hydrogen-Air Flame with Differential Diffusion. 50th AIAA Aerospace Sciences Meeting including the New Horizons Forum and Aerospace Exposition. Nashville, Tennessee. AIAA 2012-0179.

Grafke, T. (2012). Finite-time Euler singularities: A Lagrangian perspective. http://www-brs.ub.ruhr-uni-bochum.de/netahtml/HSS/Diss/GrafkeTobias/diss.pdf, Ruhr-Universität Bochum. Ph. D. thesis.

Grauer, R., H. Homann, et al. (2012). "Longitudinal and transverse structure functions in high-Reynolds-number turbulence " New J. Phys. 14: 063016.

Ivanova, E. (2012). Numerical simulations of turbulent mixing in complex flows, University of Stuttgart. PhD thesis.

Ivanova, E., B. Noll, et al. (2012). "Numerical simulations of turbulent mixing and autoignition of hydrogen fuel at reheat combustor operating conditions." Journal of Engineering for Gas Turbines and Power 134: 041504.

KHIREVICH, S., A. HÖLTZEL, et al. (2012). "Geometrical and topological measures for hydrodynamic dispersion in confined sphere packings at low column-to-particle diameter ratios." Journal of Chromatography A 1262: 77–91.

Krasnov, D., O. Zikanov, et al. (2012). " Numerical study of magnetohydrodynamic duct flow at high Reynolds and Hartmann numbers." J. Fluid Mech. 704: 421-446.

Kumar, B., F. Janetzko, et al. (2012). "Extreme responses of a coupled scalar-particle system during turbulent mixing." New J. Phys. 14: 115020.

Marinc, D. and H. Foysi (2012). "Investigation of a continuous adjoint-based optimization procedure for aeroacoustic control of plane jets." International Journal of Heat and Fluid Flow 38: 200-212.

Mellado, J. P. (2012). "Direct numerical simulation of free convection over a heated plate." J. Fluid Mech. 712: 418-450.

Rebosio, F. (2012). Methods for the numerical simulation of combustion instabilities, University of Stuttgart

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Smiatek, J. and F. Schmid (2012). Mesoscopic simulation methods for studying flow and transport in electric fields in micro- and nanochannels. Advances in Microfluidics, Chapter 5, pp. 97-126, InTech Open Access Publisher.

Uhlmann, M. and T. Doychev (2012). Finite size particles in homogeneous turbulence. NIC Symposium 2012, pp. 377–384. K. Binder, G. Münster and M. Kremer. Jülich.

Weidauer, T. and J. Schumacher (2012). "Moist turbulent Rayleigh-Benard convection with Neumann and Dirichlet boundary conditions." Phys. Fluids 24(7): 076604.

Zhou, J., A. V. Belyaev, et al. (2012). "Anisotropic flow in striped superhydrophobic channels." J. Chem. Phys. 136: 194706.

Zhou, J. and F. Schmid (2012). "Dielectric response of nanoscopic spherical colloids in alternating electric fields: a dissipative particle dynamics simulation." J. Phys.: Condens. Matter 24: 464112.

Umwelt (8)

König, M., R. Wolke, et al. (2012). Modelling of Atmospheric Processes. NIC Symposium 2012, pp. 313-320. K. Binder, G. Münster and M. Kremer. Jülich.

Kurzmann, A. (2012). Applications of 2D and 3D full waveform tomography in acoustic and viscoacoustic complex media, Karlsruhe Institute of Technology. Ph. D. thesis.

Lieber, M., V. Grützun, et al. (2012). Highly Scalable Dynamic Load Balancing in the Atmospheric Modeling System COSMO-SPECS+FD4. Lecture Notes in Computer Science, 7133, Applied Parallel and Scientific Computing, 131-141, Springer.

Mellado, J. P. and C. Ansorge (2012). Direct numerical simulation of turbulent mixing in the planetary boundary layer. NIC Symposium 2012, pp. 295-312. K. Binder, G. Münster and M. Kremer. Jülich.

Mellado, J. P. and C. Ansorge (2012). "Factorization of the Fourier transform of the pressure-Poisson equation using finite differences in colocated grids." ZAMM - Zeitschrift für angewandte Mathematik und Mechanik 92: 380 – 392.

Schlegel, M. (2012). A class of general splitting methods for air pollution methods: Theory and practical aspects, Martin Luther University of Halle. Ph. D. thesis.

Spiekermann, G. (2012). Structure and properties of SiO2-bearing aqueous fluids and glasses from first-principles modeling, FU Berlin. Ph. D. thesis.

Spiekermann, G., M. Steele-MacInnis, et al. (2012). "Vibrational mode frequencies of silica species in SiO2-H2O liquids and glasses from ab initio molecular dynamics." J. Chem. Phys. 136: 154501.