pymatgen.io.cssr module¶

This module provides input and output from the CSSR file format.

class Cssr(structure)[source]¶

Bases: object

Basic object for working with Cssr file. Right now, only conversion from a Structure to a Cssr file is supported.

Parameters: structure (Structure/IStructure) – A structure to create the Cssr object.

static from_file(filename)[source]¶

Reads a CSSR file to a Cssr object.

static from_string(string)[source]¶

Reads a string representation to a Cssr object.

write_file(filename)[source]¶

Write out a CSSR file.