How to use pymatgen: reading CIF file, material properties and inline view of structure in jupyter

Structures and Molecules in Pymatgen Interface

Most of the fundamentals of pymatgen are expressed in terms of Molecule and Structure objects. While we will mostly be using Structure , Stuctur…

How to download and install the Pymatgen Interface

Pymatgen (Python Materials Genomics) is a robust, open-source Python library for materials analysis. These are some of the main features: Highly …