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1. spin_atom_CE spin_atom_CE Public

   C-code for cluster expansion on atomic-magnetic(spin)-coupled configuration

   C

2. np_formation np_formation Public

   This program simulates the entire process of nanoparticle formation (from atoms to bulk)

   C

3. spin_atom_CE2 spin_atom_CE2 Public

   Extended version of spin_atom_CE to quaternary compounds

   C

4. spin_atom_CE3 spin_atom_CE3 Public

   Extended version of spin_atom_CE to quinary compounds, with high dimensional convex hull construction function

   C

5. psi4 psi4 Public

   Forked from psi4/psi4

   Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python

   C++