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Home » Institute » Departments & Research Groups » Scale-Bridging Thermodynamic and Kinetic Simulation » STKS Publications

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  • E. Pogorelov, J. Kundin. Programs for the calculation of the spinodal decomposition growth rate and the spinodal gap in nanoparticles. Comp. Mater Sci. Data in Brief, 15, 840-850, (2017)
  • M. Tegeler. Massively parallel multiphase field simulations. PhD thesis, (2017)
  • C. Schwarze. Simulation and Investigation of Precipitation in Aluminium Alloys. PhD Thesis, Ruhr-Universität Bochum, (2017)
  • E. Pogorelov, J. Kundin, M. Fleck. Analysis of the dependence of spinodal decomposition in nanoparticles on boundary reaction rate and free energy of mixing. Computational Materials Science, 140, 105-112, (2017)
  • F. Körmann, Y. Ikeda, B. Grabowski et al. Phonon broadening in high entropy alloys. Computational Materials, 3, 36, (2017)
  • P. Hallensleben, H. Schaar, P. Thome et al. On the evolution of cast microstructures during processing of single crystal Ni-base superalloys using a Bridgman seed technique. Materials & Design, 128, 98-111, (2017)
  • M. Tegeler, A. Monas, O. Shchyglo et al. Effect of microstructure during dendritic solidification on melt flow: A phase-field lattice-Boltzmann study. Proceedings of the 6th Decennial International Conference on Solidification Processing, (2017)
  • D. Naujoks, Y. M. Eggeler, P. Hallensleben et al. Identification of a ternary μ-phase in the Co-Ti-W system – An advanced correlative thin-film and bulk combinatorial materials investigation. Acta Materialia, 138, 100-110, (2017)
  • C. Hüter, J. Neugebauer, G. Boussinot et al. Modelling of grain boundary dynamics using amplitude equations. Continuum Mechanics and Thermodynamics, 29, 895-911, (2017)
  • R. Schiedung, R. Darvishi Kamachali, I. Steinbach et al. Multi-phase-field model for surface and phase-boundary diffusion. Physical Review E, 96, 012801, (2017)
  • I. Roslyakova. Modeling thermodynamical properties by segmented non-linear regression. PhD Thesis, (2017)
  • S. Tumminello, N. Del Negro, C. Carrascal et al. Multiphase characterization of Cu-In-Sn alloys with 17 at.% Cu and comparison with calculated phase equilibria. Journal of Phase Equilibria and Diffusion, 38, 276-287, (2017)
  • S. Vakili, I. Steinbach, F. Varnik. On the numerical evaluation of local curvature for diffuse interface models of microstructure evolution. Procedia Computer Science, 108, 1852-1862, (2017)
  • M. Tegeler, O. Shchyglo, R. Darvishi Kamachali et al. Parallel multiphase field simulations with OpenPhase. Computer Physics Communications, 215, 173 - 187, (2017)
  • F. Körmann, A. Ruban, M. Sluiter. Long-ranged interactions in bcc NbMoTaW high-entropy alloys. Materials Research Letters, 5, 35-40, (2017)
  • E. Mahmoudinezhad Zirdehi, A. Marquardt, G. Eggeler et al. Molecular dynamics simulations of entangled polymers: The effect of small molecules on the glass transition temperature. Procedia Computer Science, 108, 265-271, (2017)
  • C. Schwarze, A. Gupta, T. Hickel et al. Phase-field study of ripening and rearrangement of precipitates under chemomechanical coupling. Physical Review B, 95, 174101, (2017)
  • J. Kundin, A. Choudhary. Application of the anisotropic phase-field crystal model to investigate the lattice systems of different anisotropic parameters and orientations. Modelling and Simulation in Materials Science and Engineering, 25, 055004, (2017)
  • R. Darvishi Kamachali, C. Schwarze. Inverse ripening and rearrangement of precipitates under chemomechanical coupling. Computational Materials Science, 130, 292-296, (2017)
  • J. Kundin. Numerical investigation of the recrystallization kinetics by means of the KWC phase-field model with special order parameters. Modelling and Simulation in Materials Science and Engineering, 25, 045008, (2017)
  • A. Gupta, B. T. Kavakbasi, B. Dutta et al. Low-temperature features in the heat capacity of unary metals and intermetallics for the example of bulk aluminum and Al3Sc. Physical Review B, 95, 094307, (2017)
  • J. Görler, I. Lopez-Galilea, L. Mujica et al. Topological phase inversion after long-term thermal exposure of nickel-base superalloys: Experiment and phase-field simulation. Acta Materialia, 124, 151-158, (2017)
  • J. Hiebeler. Recovery and Recrystallization during hot deformation in austenitic steel. PhD Thesis, Ruhr-Universität Bochum, (2017)
  • I. Steinbach. Quantum-phase-field concept of matter: Emergent gravity in the dynamic universe. Zeitschrift fur Naturforschung A, 72, 51–58, (2017)
  • I. Häusler, C. Schwarze, M. Bilal et al. Precipitation of T1 and θ′ phase in Al-4Cu-1Li-0.25Mn during age hardening: Microstructural investigation and phase-field simulation. Materials, 10, 117, (2017)
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