10.57703/CE-N242N
Nöhring, Wolfram G.
Wolfram G.
Nöhring
https://orcid.org/0000-0003-4203-755X
Department of Microsystems Engineering, University of Freiburg, Georges-Köhler-Allee 103, 79110 Freiburg, Germany
Hinkle, Adam R.
Adam R.
Hinkle
https://orcid.org/0000-0001-9990-9748
Material, Physical and Chemical Sciences Center, Sandia National Laboratories, Albuquerque, NM 87123, USA
Institute for Applied Materials, Karlsruhe Institute of Technology, 76131 Karlsruhe, Germany
Pastewka, Lars
Lars
Pastewka
https://orcid.org/0000-0001-8351-7336
Department of Microsystems Engineering, University of Freiburg, Georges-Köhler-Allee 103, 79110 Freiburg, Germany
Cluster of Excellence livMatS, Freiburg Center for Interactive Materials and Bioinspired Technologies, University of Freiburg, Georges-Köhler-Allee 105, 79110 Freiburg, Germany
CuZr biaxial compression 0% strain (initial surface)
contact.engineering
2020
Dataset
FOS: Materials engineering
2020-12-03T12:27:38.180219+00:00
1
This surface is the result of a Molecular Dynamics simulation of bi-axial compression of a CuZr (50% Cu, 50% Zr) metallic glass. The initial configuration was a CuZr cube with side length 100 nm. The glass had been produced by quenching from the
melt at a rate of 1e11 K/s under fully periodic boundary conditions.
In the compression simulation, the x- and y-directions were periodic, but the z-direction was free, hence the glass had free surfaces along z. The present surface is the free surface in positive z-direction. The surface was initially atomically flat.
The glass was deformed with a rate of 1e8 s^-1 at a temperature of 100K. The temperature was controlled using a Dissipative Particle Dynamics thermostat.
This dataset contains the initial surface before compression.
The simulations have been reported in the following publication:
Hinkle, A. R.; Nöhring, W. G.; Leute, R.; Junge, T.; Pastewka, L. The Emergence of Small-Scale Self-Affine Surface Roughness from Deformation. Science Advances 2020, 6 (7), eaax0847. https://doi.org/10.1126/sciadv.aax0847.
See this publication for additional information.