Publications

Found 28 results
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Schleife A, Varley JB, Janotti A, Van de Walle CG.  2013.  Conductivity and transparency of TiO2 from first principles. SPIE Solar Energy+ Technology.
Schleife A., Varley J.B, Fuchs F., Rödl C., Bechstedt F., Rinke P., Janotti A., Van de Walle C.G.  2011.  Tin dioxide from first principles: Quasiparticle electronic states and optical properties. Phys. Rev. B. 83:35116.
Schultz D, Gardner K, Oemrawsingh SSR, sević NMarke\v, Olsson K, Debord M, Bouwmeester D, Gwinn E.  2013.  Evidence for Rod-Shaped DNA-Stabilized Silver Nanocluster Emitters. Advanced Materials. in press
Segev D., Van de Walle C.G.  2006.  Origins of Fermi-level pinning on GaN and InN polar and nonpolar surfaces. Europhys. Lett.. 76:305.
Segev D., Van de Walle C.G.  2006.  Electronic structure of nitride surfaces. Journal of Crystal Growth, First International Symposium on Growth of Nitrides - ISGN-1. 300:199-203.
Shang C, S Oh P.  2012.  Probing Gas Motions in the Intra-Cluster Medium: A Mixture Model Approach. Monthly Notices of the Royal Astronomical Society. 426:3435.
Shang C, Haiman Z, Knox L, S. Oh P.  2012.  Improved models for cosmic infrared background anisotropies: new constraints on the infrared galaxy population. Monthly Notices of the Royal Astronomical Society. 421:2832-2845.
Shapovalov V., Metiu H..  2007.  Catalysis by doped oxides: CO oxidation by AuxCe1-xO2. Journal of Catalysis. 245:205-214.
Shaw JH, Rajan VP, Blacklock M, Zok FW.  2014.  Towards Virtual Testing of Textile Composites: Calibration of Thermoelastic Tow Properties. Journal of the American Ceramic Society. 97:1209–1217.
Shaw JH, Rajan VP, Blacklock M, Zok FW.  2014.  Towards Virtual Testing of Textile Composites: Calibration of Thermoelastic Tow Properties. Journal of the American Ceramic Society. 97:1209–1217.
Shea J-E, Peter EKarl.  2014.  A hybrid MD-kMC algorithm for folding proteins in explicit solvent. Physical Chemistry Chemical Physics.
Shoemaker DP, Llobet A, Tachibana M, Seshadri R.  2011.  Reverse Monte Carlo neutron scattering study of the’ordered-ice’oxide pyrochlore Pb2Ru2O6. Journal of Physics: Condensed Matter. 23(31):315404.
Siebenhuhner F, Weiss SA, Coppola R, Weinberger DR, Bassett DS.  2012.  Intra-and Inter-Frequency Brain Network Structure in Health and Schizophrenia. arXiv preprint. arXiv:1209.0729
Sigurdsson J.K., Brown F.L.H., Atzberger P.J..  2013.  Hybrid Continuum-Particle Method for Fluctuating Lipid Bilayer Membranes with Diffusing Protein Inclusions. J. of Comp. Phys.. 252:65.
Singh N, Upham DC, Liu R-F, Burk JJames, Economou NJohn, Buratto SK, Metiu H, McFarland EW.  2014.  Investigation of the active sites of rhodium sulfide for hydrogen evolution/oxidation using carbon monoxide as a probe. Langmuir.
Singh A.K, Janotti A., Scheffler M., Van de Walle C.G.  2008.  Sources of Electrical Conductivity in SnO2. Phys. Rev. Lett.. 101:55502.
Smith A., Mizoguchi H., Delaney KT, Spaldin N.A, Sleight A., Subramanian M.A.  2009.  Mn3+ in Trigonal Bipyramidal Coordination: a New Blue Chromophore. J. Am. Chem. Soc.. 131:17084-17086.
Soto P., Baumketner A., Shea J.E..  2006.  Aggregation of polyalanine in a hydrophobic environment. J Chem Phys.. 124(13):134904.
Soto-Verdugo V, Metiu H, Gwinn E.  2010.  The properties of small Ag clusters bound to DNA bases. J. Chem. Phys.. 132:195102.
Speiser DI, Lampe RI, Lovdahl VR, Carrillo-Zazueta B, Rivera AS, Oakley TH.  2013.  Evasion of Predators Contributes to the Maintenance of Male Eyes in Sexually Dimorphic Euphilomedes ostracods (Crustacea). Integrative and Comparative Biology. (in press)
Steiauf D, Kioupakis E, Van de Walle CG.  2014.  Auger Recombination in GaAs from First Principles. ACS Photonics. 1:643–646.
Su GM, Pho TV, Eisenmenger ND, Wang C, Wudl F, Kramer EJ, Chabinyc ML.  2014.  Linking morphology and performance of organic solar cells based on decacyclene triimide acceptors. Journal of Materials Chemistry A. 2:1781–1789.
Suen JY, Fang MT, Lubin PM.  2014.  Global Distribution of Water Vapor and Cloud Cover—Sites for High-Performance THz Applications. Terahertz Science and Technology, IEEE Transactions on. 4:86–100.
Sun K, Chiu C-K, Hung H-H, Wu J.  2014.  Tuning between singlet, triplet, and mixed pairing states in an extended Hubbard chain. Phys. Rev. B. 89:104519.
Sun K, Chiu C-K, Hung H-H, Wu J.  2013.  Tuning between singlet, triplet and mixed pairing states in an extended Hubbard chain. arXiv preprint arXiv:1311.2033.

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