Virtual texture analysis to investigate the deformation mechanisms in metal microstructures at the atomic scale

Recent advances in computational materials design: methods, applications, algorithms, and informatics

“…The article by Nikolov et al [9] demonstrates new capabilities to investigate the interplay between phonon and magnetic spin contributions to the thermal conductivity of a-iron using a new spectral neighbor analysis potential. The article by Mishra et al [10] demonstrates a new capability to characterize phase and twinning variants in atomistic microstructures using a new virtual texture analysis method. The article by Gupta et al [11] targets to understand differences in the structural properties of highly charged polyacrylic acid and polymethacrylic acid using atomistic molecular dynamics simulations in the presence of divalent salt magnesium chloride, with a particular emphasis on understanding the differences pertaining to the microstructure, hydrogen bonding, intermolecular structure, and salt-ion distribution around the polymers.…”