Publikationen von Tilmann Hickel

Zeitschriftenartikel (132)

61.
Zeitschriftenartikel
Zhang, X.; Hickel, T.; Rogal, J.; Neugebauer, J.: Interplay between interstitial displacement and displacive lattice transformations. Physical Review B 94 (10), 104109 (2016)
62.
Zeitschriftenartikel
Aksyonov, D. A.; Hickel, T.; Neugebauer, J.; Lipnitskii, A. G.: The impact of carbon and oxygen in alpha-titanium: ab initio study of solution enthalpies and grain boundary segregation. Journal of Physics: Condensed Matter 28 (38), 385001 (2016)
63.
Zeitschriftenartikel
Bleskov, I.; Hickel, T.; Neugebauer, J.; Ruban, A. V.: Impact of local magnetism on stacking fault energies: A first-principles investigation for fcc iron. Physical Review B 93 (21), 214115 (2016)
64.
Zeitschriftenartikel
Di Stefano, D.; Nazarov, R.; Hickel, T.; Neugebauer, J.; Mrovec, M.; Elsässer, C.: First-principles investigation of hydrogen interaction with TiC precipitates in alpha-Fe. Physical Review B 93 (18), 184108 (2016)
65.
Zeitschriftenartikel
Körmann, F.; Hickel, T.; Neugebauer, J.: Influence of magnetic excitations on the phase stability of metals and steels. Current Opinion in Solid State and Materials Science 20 (2), S. 77 - 84 (2016)
66.
Zeitschriftenartikel
Löffler, A.; Zendegani, A.; Gröbner, J.; Hampl, M.; Schmid-Fetzer, R.; Engelhardt, H.; Rettenmayr, M. E.; Körmann, F.; Hickel, T.; Neugebauer, J.: Quaternary Al–Cu–Mg–Si Q Phase: Sample Preparation, Heat Capacity Measurement and First-Principles Calculations. Journal of Phase Equilibria 37 (2), S. 119 - 126 (2016)
67.
Zeitschriftenartikel
Raabe, D.; Roters, F.; Neugebauer, J.; Gutiérrez-Urrutia, I.; Hickel, T.; Bleck, W.; Schneider, J. M.; Wittig, J. E.; Mayer, J.: Ab initio-guided design of twinning-induced plasticity steels. MRS Bulletin 41 (4), S. 320 - 325 (2016)
68.
Zeitschriftenartikel
Yao, M.; Dey, P.; Seol, J. B.; Choi, P.-P.; Herbig, M.; Marceau, R. K. W.; Hickel, T.; Neugebauer, J.; Raabe, D.: Combined atom probe tomography and density functional theory investigation of the Al off-stoichiometry of κ-carbides in an austenitic Fe–Mn–Al–C low density steel. Acta Materialia 106, S. 229 - 238 (2016)
69.
Zeitschriftenartikel
Dutta, B.; Çaklr, A.; Giacobbe, C.; Al-Zubi, A.; Hickel, T.; Acet, M.; Neugebauer, J.: Ab initio Prediction of Martensitic and Intermartensitic Phase Boundaries in Ni–Mn–Ga. Physical Review Letters 116 (2), 025503 (2016)
70.
Zeitschriftenartikel
Sawada, H.; Kawakami, K.; Körmann, F.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Partitioning of Cr and Si between cementite and ferrite derived from first-principles thermodynamics. Acta Materialia 102, S. 241 - 250 (2016)
71.
Zeitschriftenartikel
Zhang, X.; Hickel, T.; Rogal, J.; Fähler, S.; Drautz, R.; Neugebauer, J.: Structural transformations among austenite, ferrite and cementite in Fe–C alloys: A unified theory based on ab initio simulations. Acta Materialia 99, S. 281 - 289 (2015)
72.
Zeitschriftenartikel
Grabowski, B.; Wippermann, S. M.; Glensk, A.; Hickel, T.; Neugebauer, J.: Random phase approximation up to the melting point: Impact of anharmonicity and nonlocal many-body effects on the thermodynamics of Au. Physical Review B 91 (20), 201103 (2015)
73.
Zeitschriftenartikel
Glensk, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Understanding anharmonicity in fcc Materials: From its origin to ab initio strategies beyond the quasiharmonic approximation. Physical Review Letters 114 (19), 195901 (2015)
74.
Zeitschriftenartikel
Dutta, B.; Hickel, T.; Neugebauer, J.; Behler, C.; Fähler, S.; Behler, A.; Waske, A.; Teichert, N.; Schmalhorst, J.-M.; Hütten, A.: Interplay of strain and interdiffusion in Heusler alloy bilayers. Physica Status Solidi (RRL) - Rapid Research Letters 9 (5), S. 321 - 325 (2015)
75.
Zeitschriftenartikel
Güvenç, O.; Roters, F.; Hickel, T.; Bambach, M.: ICME for Crashworthiness of TWIP Steels: From Ab Initio to the Crash Performance. JOM 67 (1), S. 120 - 128 (2015)
76.
Zeitschriftenartikel
von Appen, J.; Dronskowski, R.; Chakrabarty, A.; Hickel, T.; Spatschek, R. P.; Neugebauer, J.: Impact of Mn on the solution enthalpy of hydrogen in austenitic Fe–Mn alloys: A first-principles study. Journal of Computational Chemistry 35 (31), S. 2239 - 2244 (2014)
77.
Zeitschriftenartikel
Marquardt, O.; Boeck, S.; Freysoldt, C.; Hickel, T.; Schulz, S.; Neugebauer, J.; O'Reilly, E. P.: A generalized plane-wave formulation of k · p formalism and continuum-elasticity approach to elastic and electronic properties of semiconductor nanostructures. Computational Materials Science 95, S. 280 - 287 (2014)
78.
Zeitschriftenartikel
Dutta, B.; Hickel, T.; Entel, P.; Neugebauer, J.: Ab Initio Predicted Impact of Pt on Phase Stabilities in Ni–Mn–Ga Heusler alloys. Journal of Phase Equilibra and Diffusion 35 (6), S. 695 - 700 (2014)
79.
Zeitschriftenartikel
Körmann, F.; Grabowski, B.; Dutta, B.; Hickel, T.; Mauger, L.; Fultz, B. T.; Neugebauer, J.: Temperature dependent magnon-phonon coupling in bcc Fe from theory and experiment. Physical Review Letters 113 (16), 165503 (2014)
80.
Zeitschriftenartikel
Millán, J. C.; Sandlöbes, S.; Al-Zubi, A.; Hickel, T.; Choi, P.-P.; Neugebauer, J.; Ponge, D.; Raabe, D.: Designing Heusler nanoprecipitates by elastic misfit stabilization in Fe–Mn maraging steels. Acta Materialia 76, S. 94 - 105 (2014)
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