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Matscipy

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library 1.2.0 ·python
verified Jul 3, 2026

Matscipy is a collection of generic Python tools for materials science, building upon popular scientific computing libraries like NumPy, SciPy, and especially ASE (Atomic Simulation Environment). It provides modules for elasticity, surface generation, structure manipulation, and I/O operations for materials data. The current version is 1.2.0, and the project maintains an active development pace with multiple releases per year.

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