Faculty Profiles

Stefano Curtarolo
Professor in the Department of Chemistry
301 Hudson Hall, Box 90300, Durham, NC 27708
(919) 660-5506



Ph.D., Massachusetts Institute of Technology 2003

M.S., Pennsylvania State University 1999

M.S., University of Padua (Italy) 1995

Setyawan, W, Gaume, RM, Lam, S, Feigelson, RS, and Curtarolo, S. "High-throughput combinatorial database of electronic band structures for inorganic scintillator materials." Acs Combinatorial Science 13.4 (July 2011): 382-390. Full Text

Chepulskii, RV, and Curtarolo, S. "Ab initio insights on the shapes of platinum nanocatalysts." ACS Nano 5.1 (January 25, 2011): 247-254. Full Text

Poduska, KM, Regev, L, Boaretto, E, Addadi, L, Weiner, S, Kronik, L, and Curtarolo, S. "Decoupling local disorder and optical effects in infrared spectra: differentiating between calcites with different origins." Advanced Materials (Deerfield Beach, Fla.) 23.4 (January 2011): 550-554. Full Text

Levy, O, Jahnátek, M, Chepulskii, RV, Hart, GLW, and Curtarolo, S. "Ordered structures in rhenium binary alloys from first-principles calculations." Journal of the American Chemical Society 133.1 (January 2011): 158-163. Full Text

Jahnátek, M, Levy, O, Hart, GLW, Nelson, LJ, Chepulskii, RV, Xue, J, and Curtarolo, S. "Ordered phases in ruthenium binary alloys from high-throughput first-principles calculations." Physical Review B - Condensed Matter and Materials Physics 84.21 (2011). Full Text

Chepulskii, RV, and Curtarolo, S. "Revealing low-temperature atomic ordering in bulk Co-Pt with the high-throughput ab-initio method." Applied Physics Letters 99.26 (2011). Full Text

Curtarolo, S, Setyawan, W, and Diehl, RD. "Gas-surface interactions on quasicrystals." Israel Journal of Chemistry 51.11-12 (2011): 1304-1313. Full Text

Taylor, RH, Curtarolo, S, and Hart, GLW. "Guiding the experimental discovery of magnesium alloys." Physical Review B - Condensed Matter and Materials Physics 84.8 (2011). Full Text

Shin, H, Karimi, M, Setyawan, W, Curtarolo, S, and Diehl, RD. "Ordering and growth of Xe films on the 10-fold quasicrystalline approximant Al13Co4(100) surface." Physical Review B - Condensed Matter and Materials Physics 84.11 (2011). Full Text

Mehl, MJ, Hart, GLW, and Curtarolo, S. "Density functional study of the L10-αIrV transition in IrV and RhV." Journal of Alloys and Compounds 509.3 (2011): 560-567. Full Text