Faculty Profiles

Stefano Curtarolo
Professor in the Department of Mechanical Engineering and Materials Science
144 Hudson Hall, Durham, NC 27708
(919) 660-5310



Ph.D., Massachusetts Institute of Technology 2003

M.S., Pennsylvania State University 1999

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

Gopal, P, Fornari, M, Curtarolo, S, Agapito, LA, Liyanage, LSI, and Nardelli, MB. "Improved predictions of the physical properties of Zn- and Cd-based wide band-gap semiconductors: A validation of the ACBN0 functional." Physical Review B 91.24 (June 2015). Full Text

Mehl, MJ, Finkenstadt, D, Dane, C, Hart, GLW, and Curtarolo, S. "Finding the stable structures of with an ab initio high-throughput approach." Physical Review B 91.18 (May 2015). Full Text

Sachet, E, Shelton, CT, Harris, JS, Gaddy, BE, Irving, DL, Curtarolo, S, Donovan, BF, Hopkins, PE, Sharma, PA, Sharma, AL, Ihlefeld, J, Franzen, S, and Maria, J-P. "Dysprosium-doped cadmium oxide as a gateway material for mid-infrared plasmonics." Nature materials 14.4 (April 2015): 414-420. Full Text

Isayev, O, Fourches, D, Muratov, EN, Oses, C, Rasch, K, Tropsha, A, and Curtarolo, S. "Materials Cartography: Representing and Mining Materials Space Using Structural and Electronic Fingerprints." Chemistry of Materials 27.3 (February 10, 2015): 735-743. Full Text

Agapito, LA, Curtarolo, S, and Buongiorno Nardelli, M. "Reformulation of as a Pseudohybrid Hubbard Density Functional for Accelerated Materials Discovery." Physical Review X 5.1 (January 2015). Full Text

de Jong, M, Chen, W, Angsten, T, Jain, A, Notestine, R, Gamst, A, Sluiter, M, Krishna Ande, C, van der Zwaag, S, Plata, JJ, Toher, C, Curtarolo, S, Ceder, G, Persson, KA, and Asta, M. "Charting the complete elastic properties of inorganic crystalline compounds." Scientific data 2 (January 2015): 150009-. Full Text

Rost, CM, Sachet, E, Borman, T, Moballegh, A, Dickey, EC, Hou, D, Jones, JL, Curtarolo, S, and Maria, J-P. "Entropy-stabilized oxides." Nature communications 6 (January 2015): 8485-. Full Text

Curtarolo, S, Agapito, LA, and Buongiorno Nardelli, M. "Reformulation of DFT+U as a pseudo-hybrid Hubbard density functional for accelerated materials discovery." Phys. Rev. X 5.011006 (2015).

Carrete, J, Mingo, N, Wang, S, and Curtarolo, S. "Nanograined half-heusler semiconductors as advanced thermoelectrics: An ab initio high-throughput statistical study." Advanced Functional Materials 24.47 (December 17, 2014): 7427-7432. Full Text

Yong, J, Jiang, Y, Usanmaz, D, Curtarolo, S, Zhang, X, Li, L, Pan, X, Shin, J, Takeuchi, I, and Greene, RL. "Robust topological surface state in Kondo insulator SmB 6 thin films." Applied Physics Letters 105.22 (December 2014): 222403-222403. Full Text