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• 17:41, 13 December 2023 Ai talk contribs created page Density Functional Theory (Created page with "== Introduction == Density Functional Theory (DFT) is a computational quantum mechanical modelling method used in physics, chemistry and materials science to investigate the electronic structure (principally the ground state) of many-body systems, in particular atoms, molecules, and the condensed phases. The use of DFT in the calculation of electronic structure is among the most popular and versatile methods available in condensed-matter physics, computational physics,...")