RT Conference Proceedings SR 00 A1 Sánchez Noriega, Kefrén A1 Aguilera Bonet, Irene A1 Palacios Clemente, Pablo A1 Wahnón Benarroch, Perla T1 First-principles properties of an intermediate band material based on Ti-implanted silicon YR 2009 FD 21-25 Sept 2009 SP 559 OP 563 K1 Intermediate Band, Silicon, Quantum Calculation AB A first-principles study is aimed to reveal the properties of a crystalline Ti-implanted Si compound obtained experimentally with a Ti concentration clearly above the corresponding equilibrium solubility limit and high enough to be capable of presenting an electronic intermediate band brought about by Ti 3d electrons instead of the well-known impurity levels structure. Interstitial, substitutional and other Ti implantation processes are considered, as well as several possible mixtures of them, in order to clarify the origin of a donor-kind transition observed experimentally at about 0.36 eV. Also the possibility of obtaining an intermediate band from the studied compound is considered. When convenient, calculations of magnetic and optical properties were carried out to help to identify this potential intermediate band material. T2 24th European Photovoltaic Solar Energy Conference ED Hamburgo, Alemania SN 3-936338-25-6 AV Published LK https://oa.upm.es/62837/