Changelog

History of changes:

• Handling units cell with atoms (periodic systems): poscar file creation and poscar methods : 01/05/2017
• Handling only atoms without unit cell: aadhaar class idea: 01/06/2017
• crystal lattice class : 01/07/2017
• atom classes : 01/07/2017
• units handling class: measure folder [01/07/2017]
• vibrations class/method to generate atomic displacement: 20/08/2017
• bags concept to handle input files for different DFT software such as VASP, Quantum-Espresso, Siesta, ORCA [09/2017]
• kspace, ped (potential energy explore), transitionState, pointGroup .. [09/2017].
• potential energy exploration methods [04/2025]