Elstner98

M. Elstner, D. Porezag, G. Jungnickel, J. Elsner, M. Haugk, T. Frauenheim, S. Suhai, and G. Seifert, “Self-consistent-charge density-functional tight-binding method for simulations of complex materials properties,” Phys. Rev. B, 58 (1998) 7260-68. DOI: 10.1103/PhysRevB.58.7260