Scale-Bridging Simulation of Functional Composites (SFC)
See also for this department: Members Publications
A. Klomp, R. Khachaturyan, T. Wallis, et al. Thermal stability of nanoscale ferroelectric domains by molecular dynamics modeling Physical Review Materials 6 104411 (2022) abstract
A. Dimou, P. Hirel, A. Grünebohm, Pinning of domain walls by strontium layer in BaTiO3 perovskite: an atomic-scale study Physical Review B 106 094104 (2022) abstract
R. Khachaturyan, A. Dimou, A. Grünebohm, Domain wall acceleration by ultrafast field application: an ab initio‐based molecular dynamics study Physica status solidi (RRL) – Rapid Research Letters 16 2200038 (2022) abstract
A. Grünebohm, M. Marathe, R. Khachaturyan, et al. Interplay of domain structure and phase transitions: theory, experiment and functionality Journal of Physics: Condensed Matter 34 073002 (2022) abstract
M. Schröter, H. C. Herper, A. Grünebohm, Tuning the magnetic phase diagram of Ni-Mn-Ga by Cr and Co substitution Journal of Physics D: Applied Physics 55 025002 (2022) abstract
Y. A. Genenko, M.-H. Zhang, I. S. Vorotiahin, et al. Multistep stochastic mechanism of polarization reversal in orthorhombic ferroelectrics Physical Review B 104 184106 (2021) abstract
A. Grünebohm, M. Marathe, Impact of domains on the orthorhombic-tetragonal transition of BaTiO3: an ab initio study Physical Review Materials 4 114417 (2020) abstract
Y. A. Genenko, R. Khachaturyan, I. S. Vorotiahin, et al. Multistep stochastic mechanism of polarization reversal in rhombohedral ferroelectrics Physical Review B 102 064107 (2020) abstract
A. Biswas, Ab initio simulations of (Ba, Sr)TiO3 solid solutions Master Thesis Ruhr-Universität Bochum abstract
A. S. Everhardt, T. Denneulin, A. Grünebohm, et al. Temperature-independent giant dielectric response in transitional BaTiO3 thin films Applied Physics Reviews 7 011402 (2020) abstract
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