2 papers
cond-mat.stat-mech2026
On the Mathematics of Information-Thermodynamics
Dallin Fisher, Qi-Jun Hong
We present a validation of the asdf method, an information-theoretic framework for computing thermodynamic entropy from molecular configurations. The method reformulates entropy es…
cond-mat.mtrl-sci2025
Extending SLUSCHI for Automated Diffusion Calculations
Qi-Jun Hong, Qing Chen, Ligen Wang +6
We present an extension of the SLUSCHI package (Solid and Liquid in Ultra Small Coexistence with Hovering Interfaces) to enable automated diffusion calculations from first-principl…