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2009
P. K. Galenko, S. Reutzel, D. M. Herlach et al. Dendritic solidification in undercooled Ni-Zr-Al melts: experiments and modeling. Acta Materialia, 57, 6166-6175, (2009)
A. Saeed-Akbari, J. Imlau, U. Prahl et al. Derivation and variation in composition-dependent stacking fault energy maps based on subregular solution model in high-manganese steels. Metallurgical and Materials Transactions A, 40A, 3076-3090, (2009)
Y. Liu, L. Zhang, Y. Du et al. Ferromagnetic ordering and mobility end-members for impurity diffusion in bcc Fe. CALPHAD: Computer Coupling of Phase Diagrams and Thermochemistry, 33, 732-736, (2009)
A. Aghajani, F. Richter, C. Somsen et al. On the formation and growth of Mo-rich Laves phase particles during long-term creep of a 12% chromium tempered martensite ferritic steel. Scripta Materialia, 61, 1068-1071, (2009)
S. Ayodele, F. Varnik, D. Raabe. Transverse diffusive mixing of solutes in pressure driven microchannels: a Lattice Boltzmann study of the scaling laws. La Houille Blanche, International Water Journal, 6, 93 - 100, (2009)
T. Hammerschmidt, R. Drautz, D. G. Pettifor. Atomistic modelling of materials with bond-order potentials. International Journal of Materials Research, 100, 1479-1487, (2009)
B. Eidel. Coupling atomistic accuracy with continuum effectivity for predictive simulations in materials research - the Quasicontinuum method. International Journal of Materials Research, 100, 1503-1512, (2009)
C. Grossmann, J. Frenzel, V. Sampath et al. Elementary transformation and deformation processes and the cyclic stability of NiTi and NiTiCu shape memory spring actuators. Metallurgical and Materials Transactions A, 40, 2530-2544, (2009)
M. Gross, F. Varnik, D. Raabe. Fall and rise of small droplets on rough hydrophobic substrates. Europhysics Letters, 88, 26002, 1-6, (2009)
R. Janisch, C. Elsässer. Interstitial impurities at grain boundaries in metals: insight from atomistic calculations. International Journal of Materials Research, 100, 1488-1493, (2009)
F. Varnik, K. Binder. Multiscale modelling of polymers at interfaces. International Journal of Materials Research, 100, 1494-1502, (2009)
N. Warnken, D. Ma, A. Drevermann et al. Phase-field modelling of as-cast microstructure evolution in nickel-based superalloys. Acta Materialia, 57, 5862-5875, (2009)
E. Torres, A. T. Blumenau, P. U. Biedermann. The role of gold adatoms in self-assembled monolayers of thiol on Au(111). International Journal of Quantum Chemistry, 109, 3466 - 3472, (2009)
Y. Liu, D. Liang, L. Zhang. Thermodynamic Descriptions for the Sn-Te and Pb-Sn-Te Systems. Journal of Electronic Materials, 39, 246-257, (2009)
L. Lymperakis, M. Friák, J. Neugebauer. Atomistic calculations on interfaces: bridging the length and time scales. The European Physics Journal - Special Topics, 177, 41-57, (2009)
R. Spatschek, C. Gugenberger, E. A. Brener. Effective elastic moduli in solids with high density of cracks. Physical Review B, 80, 144106, 1-8, (2009)
A. Brener, G. Boussinot, C. Hüter et al. Pattern formation during diffusional transformations in the presence of triple junctions and elastic effects. Journal of Physics - Condensed Matter, 21, 464106, 1-10, (2009)
I. Steinbach. Pattern formation in constrained dendritic growth with solutal buoyancy. Acta Materialia, 57, 2640-2645, (2009)
I. Steinbach. Phase-field models in materials science; a tutorial review. Modelling and Simulation in Materials Science and Engineering, 17, 073001-31, (2009)
P. Suwanpinij, J. Rudnizki, U. Prahl et al. Investigation of the effect of deformation on gamma to alpha phase transformation kinetics in hot-rolled dual phase steel by phase field approach. Steel Research International, 80, 606-622, (2009)
G. Ziegenhain, A. Hartmaier, H. M. Urbassek. Pair vs many-body potentials: influence on elastic and plastic behavior in nanoindentation of fcc metals. Journal of the Mechanics and Physics of Solids , 57, 1514–1526 , (2009)
H. Meier, C. Haberland, J. Frenzel et al. Selective Laser Melting of NiTi shape memory components. Innovative Developments in Design and Manufacturing: Advanced Research in Virtual and Rapid Prototyping, 233-238, (2009)
A. Dick, T. Hickel, J. Neugebauer. The effect of disorder on the concentration-dependence of stacking fault energies in Fe_1-xMn_x - A first principles study. Steel Research International, 80, 603 - 608, (2009)
L. Ferrighi, B. Hammer, G. Madsen. 2D-3D transition for cationic and anionic gold clusters: A kinetic energy density functional study. Journal of the American Chemical Society, 131, 10605-10609, (2009)
S. Fries, B. Boettger, J. Eiken et al. Upgrading CALPHAD to microstructure simulation: the phase-field method. International Journal of Materials Research, 100, 128-134, (2009)
P. Kratzer, T. Hammerschmidt. Atomic processes in molecular beam epitaxy on strained InAs(137): a density-functional theory study. Physical Review B, 80, 035324, (2009)
S. G. Ayodele, F. Varnik, D. Raabe. Effect of aspect ratio on transverse diffusive broadening: A lattice Boltzmann study. Physical Review E, 80, 016304, 1-9, (2009)
V. Uthaisangsuk, U. Prahl, W. Bleck. Failure modeling of multiphase steels using representative volume elements based on real microstructures. Procedia Engineering, 1, 171-176, (2009)
R. Garg, A. Hüe, V. Haxha et al. Tunability of the piezoelectric fields in strained III-V semiconductors. Applied Physics Letters, 95, 041912,1-3, (2009)
B. Sundman, I. Ohnuma, N. Dupin et al. An assessment of the entire Al-Fe system including DO₃ ordering. Acta Materialia, 57, 2896-2908, (2009)
D. Peter, G. Viswanathan, M. Wagner et al. Grain-boundary sliding in a TiAl alloy with fine-grained duplex microstructure during 750 degrees C creep. Materials Science and Engineering A -Structural Materials Properties Microstructure and Processing, 510-11, 359-363, (2009)
A. Udyansky, J. von Pezold, V. N. Bugaev et al. Interplay between long-range elastic and short-range chemical interactions on Fe-C martensite formation. Physical Review B, 79, 224112, 1-5, (2009)
D. Peter, J. Pfetzing, M.F.-X. Wagner et al. Microstructural anisotropy, uniaxial and biaxial creep behavior of Ti-45Al-5Nb-0.2B-0.2C. Materials Science and Engineering: A, 510-11, 368-372, (2009)
P. Armstrong, C. Knieke, M. Mackovic et al. Microstructural evolution during deformation of tin dioxide nanoparticles in a comminution process. Acta Materialia, 57, 3060–3071, (2009)
V. Uthaisangsuk, U. Prahl, W. Bleck. Characterisation of formability behaviour of multiphase steels by micromechanical modelling. International Journal of Fracture, 157, 55-69, (2009)
Y. Chen, T. Hammerschmidt, D. G. Pettifor et al. Influence of vibrational entropy on structural stability of Nb-Si and Mo-Si systems at elevated temperatures. Acta Materialia, 57, 2657-2664 , (2009)
F. Körmann, A. Dick, T. Hickel et al. Pressure dependence of the Curie temperature in bcc iron studied by ab initio simulations. Physical Review B, 79, 184406-184411, (2009)
V. Uthaisangsuk, U. Prahl, W. Bleck. Stretch-flangeability characterisation of multiphase steel using a microstructure based failure modelling. Computational Materials Science, 45, 617-623, (2009)
G. J. Schmitz, U. Prahl. Toward a virtual platform for materials processing. JOM - Journal of the Minerals, Metals and Materials Society, 61, 19-23, (2009)
M. Apel, S. Benke, I. Steinbach. Virtual dilatometer curves and effective Young’s modulus of a 3D multiphase structure calculated by the phase-field method. Computational Materials Science, 45, 589-592 , (2009)
A. Böhner, R. Janisch, A. Hartmaier. Ab initio investigation of diamond coatings on steel . Scripta Materialia, 60, 504-507, (2009)
B. Grabowski, L. Ismer, T. Hickel et al. Ab initio up to the melting point: anharmonicity and vacancies in aluminium. Physical Review B, 79, 134106, 1-16, (2009)
J. Imlau, W. Bleck, S. Zaefferer. Comparison of damage development depending on the local microstructure in low alloyed Al-TRIP-Steels, IF steel and a DP steel. International Journal of Materials Research, 100, 584-593, (2009)
H. Zheng, J. Pfetzing-Micklich, J. Frenzel et al. Nanoindentation of Ti₅₀Ni₄₈Fe₂ and Ti₅₀Ni₄₀Cu₁₀ shape memory alloys. International Journal of Materials Research, 100, 594-602, (2009)
T. Krüger, F. Varnik, D. Raabe. Shear stress in lattice Boltzmann simulations. Physical Review E, 79, 046704, 1-14, (2009)
S. S. Khan, N. Hort, J. Eiken et al. Numerical determination of heat distribution and castability simulations of as cast Mg-Al alloys. Advanced Engineering Materials, 11, 162-168, (2009)
R. Garg, V. Haxha, M. A. Migliorato et al. Strain dependence of piezoelectric coefficients for pseudomorphically grown semiconductors. Microelectronics Journal, 40, 601-603, (2009)
C. Colinet, J. C. Tedenac, S. Fries. Structural stability of intermetallic phases in the Sn Ti system. Calphad - Experimental and Computational investigation of intermetallic systems: A Special Issue Dedicated to Prof. Riccardo Ferro, 33, 250-259, (2009)
M. Apel, B. Böttger, J. Rudnizki et al. Grain growth simulations including particle pinning using the multiphase-field concept. ISIJ International, 49, 1024-1029, (2009)
E. Torres, A. T. Blumenau, P. U. Biedermann. Mechanism for phase transitions and vacancy island formation in alkylthiol/Au(111)self-assembled monolayers based on adatom and vacancy-induced reconstructions. Physical Review B, 79, 075440, 1-6, (2009)
S.P. Brookes, H.J. Kühn, B. Skotzki et al. Multi-axial thermo-mechanical fatigue of a near-gamma TiAl-alloy. Advanced Materials Research, 59, 283-287, (2009)
T. Hickel, A. Dick, B. Grabowski et al. Steel design from fully parameter-free ab initio computer simulations. Steel Research International, 80, 4-8, (2009)
J. Pfetzing-Micklich, M. F.-X. Wagner, J. Frenzel et al. Thermomechanical constraints on pseudoelasticity during nanoindentation of binary and ternary NiTi(Fe) alloys. TMS, 639-644, (2009)
M. A. Uijttewaal, T. Hickel, J. Neugebauer et al. Understanding the phase transitions of the Ni₂MnGa magnetic shape memory system from first principles. Physical Review Letters, 102, 035702, 1-4, (2009)
B. Eidel, A. Stukowski. A variational formulation of the quasicontinuum method based on energy sampling in clusters. Journal of the Mechanics and Physics of Solids, 57, 87-108, (2009)
T. Hammerschmidt, R. Drautz. Bond-order potentials for bridging the electronic to atomistic modelling hierarchies. Multiscale Simulation Methods in Molecular Science, 229-246, (2009)
X. Guo, W. Bleck, J. Post et al. Delayed cracking in meta-stable austenitic stainless steels and its prediction by FEM simulation. Stainless Steel World Conference & Exhibition, Maastricht, (2009)
W. Bleck, K. Imlau, K. Phiu-On. Gefüge und mechanische Eigenschaften von kalt umformbaren Stählen mit TWIP/TRIP-Effekt. 9. Tagung Gefüge und Bruch, Leoben, 125-138, (2009)
J. Rudnizki, B. Zeislmair, U. Prahl et al. Gefügesimulation beim Hochtemperatur-Einsatzhärten. HTM - Journal of Heat Treatment and Materials, 64, 176-185, (2009)
D. Gosslar, R. Günther, C. Hartig et al. Grain refinement of γ-TiAl alloys by inoculation. Material Research Society Symposium Proceedings, 1128, 1128-U03-02, (2009)
M. Urban, C. Keul, W. Bleck et al. High-strength ductile bainitic steel for high-stressed forged structural parts. Proceedings of the 5^th JSTP International Seminar on Precision Forging, Kyoto, 163-166, (2009)
W. Bleck. High-strength steels for car bodies. Proceedings of the 2009 International Symposium on Automobile Steel, Dalian, China., 27-32, (2009)
C. Kords. Leistungssteigerung beim trochoiden Fräsen durch Optimierung der mikroskopischen und makroskopischen Eingriffsbedingungen. Master Thesis, RWTH Aachen, (2009)
V. Uthaisangsuk, U. Prahl, W. Bleck. Microstructure based failure analysis of multiphase steels using damage mechanics modeling. TMS 2009, 138^th Annual Meeting & Exhibition, Supplemental Proceedings, Materials Characterization, Computation and Modeling, 2, 335-343, (2009)
M. Fischer, F. Gerdemann, W. Bleck. Object based quantitative analysis of complex multiphase microstructures in steel. EPD Congress 2009, TMS 2009, San Francisco (CA), 101-109, (2009)
W. Bleck. Quantum mechanics guided design of new Fe based materials. Proceedings of the Workshop on High Mn Steels, Pohang, 1, 1-39, (2009)
J. von Appen, W. Bleck, S. Brühl et al. SFB 761 - Stahl ab initio: Quantenmechanisch geführtes Design neuer Eisenbasiswerkstoffe. Jahresmagazin Ingenieurwissenschaften, 132-134, (2009)
W. A. Counts, M. Friák, D. Raabe et al. Using ab initio calculations in designing bcc Mg–Li alloys for ultra-lightweight applications. Acta Materialia, 57 , 69-76, (2009)

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2009