Linux4Chemistry - Linux software for chemistry: molecular modeling, visualization, graphic, quantum mechanic, dynamic, kinetic, simulationABINIT is a package whose main program allows one to find the total energy, charge density and electronic structure of systems made of electrons and nuclei (molecules and periodic solids) within Density Functional Theory (DFT), using pseudopotentials and a planewave basis. Excited states can be computed within the Time-Dependent Density Functional Theory (for molecules), or within Many-Body Pertur
