Journal Article (533)
321.
Journal Article
17 (9), 093004 (2015)
Synergy of atom-probe structural data and quantum-mechanical calculations in a theory-guided design of extreme-stiffness superlattices containing metastable phases. New Journal of Physics 322.
Journal Article
252 (9), pp. 1907 - 1924 (2015)
Importance of coordination number and bond length in titanium revealed by electronic structure investigations. Physica Status Solidi B 323.
Journal Article
92 (8), 085204, pp. 5204 - 5210 (2015)
Role of biaxial strain and microscopic ordering for structural and electronic properties of InxGa1-xN. Physical Review B 324.
Journal Article
98, 12303, pp. 367 - 376 (2015)
Ab initio study of compositional trends in solid solution strengthening in metals with low Peierls stresses. Acta Materialia 325.
Journal Article
92 (6), 064107 (2015)
From generalized stacking fault energies to dislocation properties: Five-energy-point approach and solid solution effects in magnesium. Physical Review B 326.
Journal Article
111 (4), 48004 (2015)
Aging in amorphous solids: A study of the first-passage time and persistence time distributions. EPL 327.
Journal Article
92 (1), 014202 (2015)
Configurational order-disorder induced metal-nonmetal transition in B13C2 studied with first-principles superatom-special quasirandom structure method. Physical Review B 328.
Journal Article
91 (21), 214311 (2015)
Improved method of calculating ab initio high-temperature thermodynamic properties with application to ZrC. Physical Review B 329.
Journal Article
92, pp. 55 - 63 (2015)
Origin of shear induced β to ω transition in Ti–Nb-based alloys. Acta Materialia 330.
Journal Article
119 (21), pp. 11438 - 11446 (2015)
Ab Initio Nonequilibrium Thermodynamic and Transport Properties of Ultrafast Laser Irradiated 316L Stainless Steel. The Journal of Physical Chemistry C 331.
Journal Article
117 (19), 195301 (2015)
Growth and oxidization stability of cubic Zr1-xGdxN solid solution thin films. Journal of Applied Physics 332.
Journal Article
90, pp. 69 - 76 (2015)
A first principles investigation of zine induced embrittlement at grain boundaries in bcc iron. Acta Materialia 333.
Journal Article
91 (20), 201103 (2015)
Random phase approximation up to the melting point: Impact of anharmonicity and nonlocal many-body effects on the thermodynamics of Au. Physical Review B 334.
Journal Article
114 (19), 195901 (2015)
Understanding anharmonicity in fcc Materials: From its origin to ab initio strategies beyond the quasiharmonic approximation. Physical Review Letters 335.
Journal Article
252 (5), pp. 855 - 865 (2015)
Ab initio-based bulk and surface thermodynamics of InGaN alloys: Investigating the effects of strain and surface polarity. Physica Status Solidi B 336.
Journal Article
9 (5), pp. 321 - 325 (2015)
Interplay of strain and interdiffusion in Heusler alloy bilayers. Physica Status Solidi (RRL) - Rapid Research Letters 337.
Journal Article
89, pp. 50 - 59 (2015)
Multiscale description of dislocation induced nano-hydrides. Acta Materialia 338.
Journal Article
85, pp. 53 - 66 (2015)
Computationally efficient and quantitatively accurate multiscale simulation of solid-solution strengthening by ab initio calculation. Acta Materialia 339.
Journal Article
5, 7841 (2015)
Velocity-strengthening friction significantly affects interfacial dynamics, strength and dissipation. Scientific Reports 340.
Journal Article
67 (1), pp. 120 - 128 (2015)
ICME for Crashworthiness of TWIP Steels: From Ab Initio to the Crash Performance. JOM