3 papers
cond-mat.stat-mech2021
Efficient, Systematic Estimation of Alloy Free Energy from Special Microscopic States
Ryogo Miyake, Subaru Sugie, Koretaka Yuge
For classical discrete systems under constant composition typically refferred to substitutional alloys, we propose calculation method of Helmholtz free energy based on a set of spe…
cond-mat.stat-mech2019
Configurational Geometry Bridges Equilibrium Structure Information from a Single to Multiple Compositions
Shouno Ohta, Ryogo Miyake, Koretaka Yuge
For classical discrete systems under constant composition, a set of microscopic state dominantly contributing to thermodynamically equilibrium structure should depend on temperatur…
cond-mat.stat-mech2019
Modified Representation of Canonical Average by Special Microscopic States for Classical Discrete Systems
Koretaka Yuge, Shouno Ohta, Ryogo Miyake
For substitutional crystalline solids typically referred to classical discrete system under constant composition, macroscopic structure in thermodynamically equilibrium state can b…