eyring_model

Code to analyze the behavior of the heterogeneous Eyring model for transport through membranes. Accompanying paper: [https://doi.org/10.1016/j.memsci.2024.123233]

Name		Name	Last commit message	Last commit date
Latest commit History 129 Commits
csv_data		csv_data
figs		figs
.gitignore		.gitignore
README.md		README.md
avg_convergence_exp_100iter.csv		avg_convergence_exp_100iter.csv
avg_convergence_norm_100iter.csv		avg_convergence_norm_100iter.csv
barrier_variance.ipynb		barrier_variance.ipynb
estimate_paths_per_area.ipynb		estimate_paths_per_area.ipynb
exceptions.py		exceptions.py
experimental_barriers.ipynb		experimental_barriers.ipynb
eyring_model.bib		eyring_model.bib
eyring_model.py		eyring_model.py
flux_profile.ipynb		flux_profile.ipynb
jump_distribution_analysis.ipynb		jump_distribution_analysis.ipynb
mpi_run_analyses.py		mpi_run_analyses.py
plotting_paths.ipynb		plotting_paths.ipynb
run_analyses.py		run_analyses.py

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