Publications

Kerdsongpanya, S.; Sun, B.; Eriksson, F.; Jensen, J. A. D.; Lu, J.; Koh, Y. K.; Nong, N.; Balke, B.; Alling, B.; Eklund, P.: Experimental and theoretical investigation of Cr_1-xSc_xN solid solutions for thermoelectrics. Journal of Applied Physics 120 (21), 215103 (2016)

Morsdorf, L.; Jeannin, O.; Barbier, D.; Mitsuhara, M.; Raabe, D.; Tasan, C. C.: Multiple mechanisms of lath martensite plasticity. Acta Materialia 121, pp. 202 - 214 (2016)

Shulumba, N.; Hellman, O.; Raza, Z.; Alling, B.; Barrirero, J.; Mücklich, F. T.; Abrikosov, I. A.; Odén, M.: Lattice vibrations change the solid solubility of an alloy at high temperatures. Physical Review Letters 117 (20), 205502 (2016)

Hadian, R.; Grabowski, B.; Race, C. P.; Neugebauer, J.: Atomistic migration mechanisms of atomically flat, stepped, and kinked grain boundaries. Physical Review B 94 (16), 165413 (2016)

Djaziri, S.; Li, Y.; Nematollahi, G. A.; Grabowski, B.; Goto, S.; Kirchlechner, C.; Kostka, A.; Doyle, S.; Neugebauer, J.; Raabe, D. et al.; Dehm, G.: Deformation-Induced Martensite: A New Paradigm for Exceptional Steels. Advanced Materials 28 (35), pp. 7753 - 7757 (2016)

Oh, H. S.; Ma, D.; Leyson, G.; Grabowski, B.; Park, E. S.; Körmann, F.; Raabe, D.: Lattice Distortions in the FeCoNiCrMn High Entropy Alloy Studied by Theory and Experiment. Entropy 18 (9), p. 321 - 321 (2016)

Mozafari, E.; Shulumba, N.; Steneteg, P.; Alling, B.; Abrikosov, I. A.: Finite-temperature elastic constants of paramagnetic materials within the disordered local moment picture from ab initio molecular dynamics calculations. Physical Review B 94 (5), 054111 (2016)

Ektarawong, A.; Simak, S. I.; Alling, B.: Carbon-rich icosahedral boron carbides beyond B4 C and their thermodynamic stabilities at high temperature and pressure from first principles. Physical Review B 94 (5), 054104 (2016)

Maisel, S.; Höfler, M.; Müller, S. G.: Configurationally exhaustive first-principles study of a quaternary superalloy with a vast configuration space. Physical Review B 94 (1), 014116 (2016)

Huang, L.; Grabowski, B.; Zhang, J.; Lai, M.; Tasan, C. C.; Sandlöbes, S.; Raabe, D.; Neugebauer, J.: From electronic structure to phase diagrams: A bottom-up approach to understand the stability of titanium-transition metal alloys. Acta Materialia 113, pp. 311 - 319 (2016)

Li, Z.; Yang, X.; Zhang, J.; Shan, A.: Interfacial Mechanical Behavior and Electrochemical Corrosion Characteristics of Cold-Sprayed and Hot-Rolled Titanium/Stainless-Steel Couples. Advanced Engineering Materials 18 (7), pp. 1240 - 1249 (2016)

Olovsson, W.; Alling, B.; Magnuson, M.: Structure and Bonding in Amorphous Cr_1-xC_x Nanocomposite Thin Films: X-ray Absorption Spectra and First-Principles Calculations. The Journal of Physical Chemistry C 120 (23), pp. 12890 - 12899 (2016)

Kim, J.-K.; Ko, W.-S.; Sandlöbes, S.; Heidelmann, M.; Grabowski, B.; Raabe, D.: The role of metastable LPSO building block clusters in phase transformations of an Mg–Y–Zn alloy. Acta Materialia 112, pp. 171 - 183 (2016)

Alling, B.; Körmann, F.; Grabowski, B.; Glensk, A.; Abrikosov, I. A.; Neugebauer, J.: Strong impact of lattice vibrations on electronic and magnetic properties of paramagnetic Fe revealed by disordered local moments molecular dynamics. Physical Review B 93 (22), 224411 (2016)

Li, Z.; Pradeep, K. G.; Deng, Y.; Raabe, D.; Tasan, C. C.: Metastable high-entropy dual-phase alloys overcome the strength–ductility trade-off. Nature 534, pp. 227 - 230 (2016)

Kaplan, B.; Korbmacher, D.; Blomqvist, A.; Grabowski, B.: Finite temperature ab initio calculated thermodynamic properties of orthorhombic Cr₃C₂. Calphad 53, pp. 72 - 77 (2016)

Lai, M.; Tasan, C. C.; Raabe, D.: On the mechanism of {332} twinning in metastable β titanium alloys. Acta Materialia 111, pp. 173 - 186 (2016)

Nematollahi, G. A.; Grabowski, B.; Raabe, D.; Neugebauer, J.: Multiscale description of carbon-supersaturated ferrite in severely drawn pearlitic wires. Acta Materialia 111, pp. 321 - 334 (2016)

Wang, M.; Tasan, C. C.; Ponge, D.; Raabe, D.: Spectral TRIP enables ductile 1.1 GPa martensite. Acta Materialia 111, pp. 262 - 272 (2016)

Li, Z.; Zheng, B.; Kurmanaeva, L. R.; Zhou, Y. Z.; Valiev, R. Z.; Lavernia, E. J.: High-strain induced reverse martensitic transformation in an ultrafine-grained Ti–Nb–Ta–Zr alloy. Philosophical Magazine Letters 96 (5), pp. 189 - 195 (2016)