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2014
- N. Gunda. Coarse grained lattice dynamics using compressive sensing. Master Thesis, Ruhr-Universität Bochum, (2014)
- A. Breidi, M. Andasmas, J. Crivello et al. Experimental and computed phase diagrams of the Fe-Re system. Journal of Physics: Condensed Matter, 26, 485402, (2014)
- L. Klein, A. Zendegani, M. Palumbo et al. First approach for thermodynamic modelling of the high temperature oxidation behaviour of ternary γ strengthened Co-Al-W superalloys. Corrosion Science, 89, 1-5, (2014)
- F. Farahpour, M. Ejtehadi, F. Varnik. Polyelectrolytes polarization in nonuniform electric fields. International Journal of Modern Physics C, 25, 1 - 9, (2014)
- A. Zendegani. Modelling the morphological instability of the oxidation front in binary alloys by phase-field. Master Thesis, Ruhr-Universität Bochum, (2014)
- L. Govinda Sharma. Effect of martensite fraction on cooling rate and grain size. Master Thesis, Ruhr-Universität Bochum, (2014)
- N. Alemayehu. Intercalation kinetics of battery- and related materials. PhD Thesis, Ruhr-Universität Bochum, (2014)
- M. Ilyas. Lagrangian dynamics simulation of cubic to tetragonal martensitic phase transformations. Master Thesis, Ruhr-Universität Bochum, (2014)
- M. Rajendran, O. Shchyglo, I. Steinbach. Large scale 3-D phase-field simulation of coarsening in Ni-base superalloys. MATEC Web of Conferences: EUROSUPERALLOYS 2014 – 2nd European Symposium on Superalloys and their Applications, 14, 11001, (2014)
- C. Bera, S. Jacob, I. Opahle et al. Integrated computational materials discovery of silver doped tin sulfide as a thermoelectric material. Physical Chemistry Chemical Physics, 16, 19894-19899, (2014)
- S. Mandal, S. Lang, M. Gross et al. Multiple reentrant glass transitions in confined hard-sphere glasses. Nature Communications, 5, 4435, (2014)
- V. Sai Pavan Bhogireddy, C. Hüter, J. Neugebauer et al. Phase-field modeling of grain-boundary premelting using obstacle potentials. Physical Review E, 90, 012401, (2014)
- M. Palumbo, S. Fries, A. Dal Corso et al. Reliability evaluation of thermophysical properties from first-principles calculations. Journal of Physics: Condensed Matter, 26, 335401, (2014)
- M. Ghasemi, B. Sundman, S. Fries et al. The thermodynamic assessment of the Au-In-Ga system. Journal of Alloys and Compounds, 600, 178–185, (2014)
- M. Palumbo, S. Fries, A. Pasturel et al. Anharmonicity, mechanical instability, and thermodynamic properties of the Cr-Re σ-phase. The Journal of Chemical Physics, 140, 144502, (2014)
- R. Drautz, I. Steinbach. Applications of scale-bridging to computational materials design. Modelling and Simulation in Materials Science and Engineering, 22, 030201, (2014)
- F. Varnik, S. Mandal, V. Chikkadi et al. Correlations of plasticity in sheared glasses. Physical Review E, 89, 1 - 6, (2014)
- R. Darvishi Kamachali, E. Borukhovich, N. Hatcher et al. DFT-supported phase-field study on the effect of mechanically driven fluxes in Ni4Ti3 precipitation. Modelling and Simulation in Materials Science and Engineering, 22, 034003, (2014)
- E. Borukhovich, P. Engels, T. Böhlke et al. Large strain elasto-plasticity for diffuse interface models. Modelling and Simulation in Materials Science and Engineering, 22, 034008, (2014)
- H. Kim, S. Kim, W. Dong et al. Phase-field modeling for 3D grain growth based on a grain boundary energy database. Modelling and Simulation in Materials Science and Engineering, 22, 034004, (2014)
- F. Falsafi. Thermophysical properties of Ti and Ni-Ti alloys: first-principle calculations compared to evaluated emperimental results. Master Thesis, Ruhr-Universität Bochum, (2014)
- M. Gross, T. Krüger, F. Varnik. Rheology of dense suspensions of elastic capsules: normal stresses, yield stress, jamming and confinement effects. Soft Matter, 10, 4360-4372, (2014)
- H. Emmerich, P. Virnau, G. Wilde et al. Heterogeneous nucleation and microstructure formation: steps towards a system and scale bridging understanding. European Physical Journal Special Topics, 223, 337-346, (2014)
- M. Addis. Lattice Boltzmann studies of non-Newtonian fluids. Master Thesis, Ruhr-Universität Bochum, (2014)
- M. M. Franke, R. Singer, I. Steinbach. Tertiary dendritic instability in late stage solidification of Ni-based superalloys. Modelling and Simulation in Materials Science and Engineering, 22, 025026, (2014)
- T. Hickel, U. Kattner, S. Fries. Computational thermodynamics: recent developments and future potential and prospects. Physica Status Solidi B, 251, 9-13, (2014)
- M. Palumbo, S. Fries, T. Hammerschmidt et al. First-principles-based phase diagrams and thermodynamic properties of TCP phases in Re-X systems (X = Ta, V, W) . Computational Materials Science, 81, 433-445, (2014)
- T. Hammerschmidt, I.A. Abrikosov, D. Alfe et al. Including the effects of pressure and stress in thermodynamic functions. Physica Status Solidi B, 251, 81-96, (2014)
- F. Körmann, A. Breidi, S. Dudarev et al. Lambda transitions in materials science: recent advances in CALPHAD and first-principles modelling. Physica Status Solidi B, 251, 53-80, (2014)
- J. Görler. Mesoscopic simulation of the influence of misfit dislocations on the morphology of the γ′-phase in Ni-Base superalloys. Master Thesis, Ruhr-Universität Bochum, (2014)
- J. Rogal, S. V. Divinski, M. Finnis et al. Perspectives on point defect thermodynamics. Physica Status Solidi B, 251, 97-129, (2014)
- W. Arif. Superalloy single crystal creep deformation modelling by crystal plasticity finite element method. Master Thesis, Ruhr-Universität Bochum, (2014)
- M. Palumbo, B. Burton, A. Costa e Silva et al. Thermodynamic modelling of crystalline unary phases. Physica Status Solidi B, 251, 14-32, (2014)