1 citations · 1 across the 1 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2017
Stability and elasticity of metastable solid solutions and superlattices in the MoN-TaN system: a first-principles study
Nikola Koutná, David Holec, Martin Friák +2
Employing ab initio calculations, we discuss chemical, mechanical, and dynamical stability of MoN-TaN solid solutions together with cubic-like MoN/TaN superlattices, as another mat…
cond-mat.mtrl-sci2016
Non-linear elastic effects in phase field crystal and amplitude equations: Comparison to ab initio simulations of bcc metals and graphene
C. Hüter, M. Friák, M. Weikamp +4
We investigate non-linear elastic deformations in the phase field crystal model and derived amplitude equations formulations. Two sources of non-linearity are found, one of them ba…
cond-mat.mtrl-sci2008★ 1 cited
Ab-initio simulation and experimental validation of beta-titanium alloys
D. Raabe, B. Sander, M. Friak +2
In this progress report we present a new approach to the ab-initio guided bottom up design of beta-Ti alloys for biomedical applications using a quantum mechanical simulation metho…