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7 public repositories
matching this topic...
A tool for calculating distortion parameters in coordination complexes.
Updated
Nov 8, 2025
Python
OctaDist package for PyPI.
Updated
Jun 9, 2019
Python
Small program for spin crossover simulation in Ising model aproximation utlizing Monte Carlo method
Updated
Jul 6, 2022
Fortran
Python interface to compute thermodynamic analyses of spin crossover in molecules and solid state materials
Updated
Nov 14, 2025
Jupyter Notebook
Official website of OctaDist program.
Python scripts to analyze dinuclear SCO systems using the Slichter–Drickamer model.
Updated
Nov 27, 2025
HTML
A Python module for conducting DFT and G0W0 computations on spin-crossover molecules and solids using GPAW and ASE
Updated
Dec 19, 2025
Python
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