2 papers
cond-mat.mtrl-sci2025
ALATDYN: a set of Anharmonic LATtice DYNamics codes to compute thermodynamic and thermal transport properties of crystalline solids
Keivan Esfarjani, Harold Stokes, Safoura Nayeb Sadeghi +6
We introduce a lattice dynamics package which calculates elastic, thermodynamic and thermal transport properties of crystalline materials from data on their force and potential ene…
cond-mat.stat-mech2017
An epicycle method for elasticity limit calculations
Axel van de Walle, Sara Kadkhodaei, Ruoshi Sun +1
The task of finding the smallest energy needed to bring a solid to its onset of mechanical instability arises in many problems in materials science, from the determination of the e…