This dataset is associated with research paper Influence of filler and fabrication temperature on microstructure and electrical properties for oxide-halide perovskite composites based on Pb(Zr,Ti)O3,
The files in this data repository are used in various sections of the manuscript "ExaCA v2.0: A versatile, scalable, and performance portable cellular automata application for additive manufacturing s
This dataset describes the nickel-platinum (NiPt) solid solution binary alloy, where the two constituent elements nickel (Ni) and platinum (Pt) are randomly placed on the face centered cubic (FCC) cry
DFT is used to optimize defects in monolayer MX2 phases. We calculate ~600 optimized defect structures, then use multislice simulations in abTEM to generate STEM digital twins, which can be used to tr
