Skip to content

This code can be used to simulate the order-disorder transition in multi-component alloys (high-entropy alloys). The code takes simulated annealing algorithm and Ising-model like Hamiltonian as energy input. The code can give specific heat curve, transition temperature and temperature dependent long-range (LRO) and short-range order (SRO) param…

License

Notifications You must be signed in to change notification settings

peizong/Simulated-Annealing-Metropolis-MC-

Repository files navigation

Simulated-Annealing-Metropolis-MC-

This code can be used to simulate the order-disorder transition in multi-component alloys (high-entropy alloys). The code takes simulated annealing algorithm and Ising-model like Hamiltonian as energy input. The code can give specific heat curve, transition temperature and temperature dependent long-range (LRO) and short-range order (SRO) parameters. The code is written in C++ code. In order to use the code the users need to firstly install ATAT package of Dr. A. van de Walle of Brown University.

Follow this example to perform parallel Metropolis Monte-Carlo simulations.

Simulated-Annealing-Metropolis-MC-/examples/AlCoCrFeNi/

About

This code can be used to simulate the order-disorder transition in multi-component alloys (high-entropy alloys). The code takes simulated annealing algorithm and Ising-model like Hamiltonian as energy input. The code can give specific heat curve, transition temperature and temperature dependent long-range (LRO) and short-range order (SRO) param…

Resources

License

Stars

Watchers

Forks

Releases

No releases published

Packages

No packages published