2 papers
cond-mat.mtrl-sci2025
Physically-Constrained Autoencoder-Assisted Bayesian Optimization for Refinement of High-Dimensional Defect-Sensitive Single Crystalline Structure
Joseph Oche Agada, Andrew McAninch, Haley Day +6
Physical properties and functionalities of materials are dictated by global crystal structures as well as local defects. To establish a structure-property relationship, not only th…
cond-mat.str-el2004
Low temperature phase transitions and crystal structure of Na0.5CoO2
Q. Huang, M. L. Foo, J. W. Lynn +7
The crystal structure of Na0.5CoO2, determined by powder neutron diffraction, is reported. The structure consists of layers of edge-shared CoO6 octahedra in a triangular lattice, w…