From the 1 of 63 papers with an AI index.
18 citations
- Goddard Space Flight CenterUS13 papers
- University of MichiganUS10 papers
- University of Maryland, College ParkUS9 papers
- California Institute of TechnologyUS7 papers
- National Radio Astronomy ObservatoryUS7 papers
- Eötvös Loránd UniversityHU6 papers
- Instituto de Astrofísica de CanariasES6 papers
- Search for Extraterrestrial IntelligenceUS6 papers
- University of BirminghamGB6 papers
- University of British ColumbiaCA6 papers
- University of TorontoCA6 papers
- Arizona State UniversityUS5 papers
6 papers · 1 filter
Interatomic potentials for platinum
R. K. Koju, Y. Li, Y. Mishin
We present two new interatomic potentials for platinum (Pt) in angular-dependent potential (ADP) and modified Tersoff (MT) formats. Both potentials have been trained on a reference…
A phase field model with arbitrary misorientation dependence of grain boundary energy
Philip Staublin, Yuri Mishin, Peter W. Voorhees +1
Grain growth in polycrystals is often simulated using orientation-field models, which employ a field to represent the local orientation of the crystal lattice. These models can be…
The effect of normal stress on stacking fault energy in face-centered cubic metals
Yang Li, Yuri Mishin
Plastic deformation and fracture of FCC metals involve the formation of stable or unstable stacking faults (SFs) on (111) plane. Examples include dislocation cross-slip and disloca…
Tuning of altermagnetism by strain
M. Khodas, Sai Mu, I. I. Mazin +1
For all collinear altermagnets, we sort out piezomagnetic free-energy invariants allowed in the nonrelativistic limit and relativistic piezomagnetic invariants bilinear in the Née…
Effect of Misfit and Threading Dislocations on Surface Energies of PbTe-PbSe Interfaces
Emir Bilgili, Nicholas Taormina, Yang Li +3
This work quantifies the effect of misfit and threading dislocations on the surface energies of PbTe-PbSe interfaces, with the defect structures of the interfaces being obtained fr…
Performance Improvement of Deorbitalized Exchange-Correlation Functionals
H. Francisco, B. Thapa, S. B. Trickey +1
Deorbitalization of a conventional meta-generalized-gradient exchange-correlation approximation replaces its dependence upon the Kohn-Sham kinetic energy density with a dependence…