Extract detailed information from CIF files effortlessly with these Python scripts. Leveraging pymatgen and ASE libraries, these scripts provide crystal structure info, atomic data extraction, and versatility for seamless integration into various computational physics workflows.

pymatgen: A Python library for materials analysis. ASE: Atomic Simulation Environment for electronic structure calculations.

• pip install pymatgen ase

• Crystal Structure Analysis: Utilizes pymatgen to parse CIF files and perform in-depth analysis of crystal structures.
• Atomic Information Extraction: Uses ASE to extract atomic information, such as atomic positions and cell parameters, from CIF files.