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Issue DateTitleAuthor(s)
1-Jan-2009Electronic structure of III-V’s semiconductors from B3LYP and PBE0 functionalsTomic, S; Harrison, NM; Caldas MJ, Studart N
15-Jan-2011Chemistry of defect induced photoluminescence in chalcopyrites: The case of CuAlS2Liborio, LM; Bailey, CL; Mallia, G; Tomic, S; Harrison, NM
29-Dec-2008Absorption characteristics of a quantum dot array induced intermediate band: Implications for solar cell designTomic, S; Jones, TS; Harrison, NM
-The DL EXCURV PackageTomic, S; Searle, BG; Wander, A; Harrison, NM; Dent, A, et al
15-Apr-2010Geometric structure of TiO2(110)(1X1): Confirming experimental conclusionsBusayaporn, W; Torrelles, X; Wander, A; Tomic, S; Ernst, A, et al
15-May-2010Defect physics of CuGaS2Bailey, CL; Liborio, L; Mallia, G; Tomic, S; Harrison, NM
8-Jul-2011Parallel implementation of the ab initio CRYSTAL program: electronic structure calculations for periodic systemsBush, IJ; Tomic, S; Searle, BG; Mallia, G; Bailey, CL, et al
31-May-2011First-principles optical response of semiconductors and oxide materialsBernasconi, L; Tomic, S; Ferrero, M; Rerat, M; Orlando, R, et al