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1. BH-FHI_aims BH-FHI_aims Public

   Basin Hopping Algorithm coupled with FHI-aims DFT software for geometry optimization of metal nanoclusters

   C++ 1 1

2. MolecularAdsorption MolecularAdsorption Public

   This is a C-Bash code to generate initial configurations for the study of adsorption of molecules in metallic clusters

   Shell 1

3. VASP_to_XYZ VASP_to_XYZ Public

   How to convert POSCAR (VASP) to xyz and viceversa

   C++ 7 9