reverse-monte-carlo

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OVITO Python modifier to generate bulk crystal structures with target Warren-Cowley parameters.

C++23 Reverse Monte Carlo for atomic structure refinement against PDF g(r) / S(Q) and ADF data, with mcSQS special quasirandom structure generation

Browser-based RMCProfile dashboard, with interactive plots, KDE, PCA, 3D structures, symmetry tools, and LLM-based AI Assistant support.

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