Publications
Journal Article (41)
1.
Journal Article
98, 224106 (2018)
Temperature dependence of the stacking-fault Gibbs energy for Al, Cu, and Ni. Physical Review B 2.
Journal Article
121 (25), 255502 (2018)
Segregation-Induced Nanofaceting Transition at an Asymmetric Tilt Grain Boundary in Copper. Physical Review Letters 3.
Journal Article
157, pp. 54 - 57 (2018)
Bulk nanocrystalline gamma magnesium hydride with low dehydrogenation temperature stabilized by plastic straining via high-pressure torsion. Scripta Materialia 4.
Journal Article
4 (1), 64 (2018)
A machine learning approach to model solute grain boundary segregation. npj Computational Materials 5.
Journal Article
161, pp. 412 - 419 (2018)
Dislocation slip transmission through a coherent Σ3{111} copper twin boundary: Strain rate sensitivity, activation volume and strength distribution function. Acta Materialia 6.
Journal Article
233, pp. 44 - 50 (2018)
DIST: A dislocation-simulation toolkit. Computer Physics Communications 7.
Journal Article
8 (1), 9147 (2018)
Role of disorder when upscaling magnetocaloric Ni–Co–Mn–Al Heusler alloys from thin films to ribbons. Scientific Reports 8.
Journal Article
3, 900 (2018)
GB code: A grain boundary generation code. The Journal of Open Source Software 9.
Journal Article
121 (12), 125902 (2018)
Anomalous Phonon Lifetime Shortening in Paramagnetic CrN Caused by Spin-Lattice Coupling: A Combined Spin and Ab Initio Molecular Dynamics Study. Physical Review Letters 10.
Journal Article
2 (9), 093608 (2018)
Resolving the debated atomic structure of the metastable cubic SiNx tissue phase in nanocomposites with TiN. Physical Review Materials 11.
Journal Article
2 (9), 093606 (2018)
110 planar faults in strained bcc metals: Origins and implications of a commonly observed artifact of classical potentials. Physical Review Materials 12.
Journal Article
11 (9), 1732 (2018)
Origin of the Low Magnetic Moment in Fe2AlTi: An Ab Initio Study. Materials 13.
Journal Article
98 (9), 094413 (2018)
Assessing the SCAN functional for itinerant electron ferromagnets. Physical Review B 14.
Journal Article
98 (6), 064105 (2018)
Lattice relaxations in disordered Fe-based materials in the paramagnetic state from first principles. Physical Review B 15.
Journal Article
20 (9), 655 (2018)
Impact of chemical fluctuations on stacking fault energies of CrCoNi and CrMnFeCoNi high entropy alloys from first principles. Entropy 16.
Journal Article
6 (8), pp. 1429 - 1447 (2018)
Coupling Phenomena in Magnetocaloric Materials. Energy Technology 17.
Journal Article
2 (7), 073801 (2018)
Precipitate-induced nonlinearities of diffusion along grain boundaries in Al-based alloys. Physical Review Materials 18.
Journal Article
121 (015702), 015702, pp. 1 - 5 (2018)
Strain-Induced Asymmetric Line Segregation at Faceted Si Grain Boundaries. Physical Review Letters 19.
Journal Article
106, pp. 48 - 56 (2018)
Origin of the sensitivity in modeling the glide behaviour of dislocations. International Journal of Plasticity 20.
Journal Article
97 (21), 214106 (2018)
Temperature dependence of the Gibbs energy of vacancy formation of fcc Ni. Physical Review B