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2014

Himmetoglu B, Janotti A, Bjaalie L, Van de Walle CG. 2014. Interband and polaronic excitations in YTiO 3 from first principles. Physical Review B. 90:161102.

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.

Wang X, Vallurupalli P, Vu A, Lee K, Sun S, Bai W-J, Wu C, Zhou H, Shea J-E, Kay LE et al.. 2014. The linker between the dimerization and catalytic domains of the CheA histidine kinase propagates changes in structure and dynamics that are important for enzymatic activity. Biochemistry. 53:855–861.

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.

Tang X, Alabduljalil M, Jin X, Yang T. 2014. Load balancing for partition-based similarity search. Proceedings of the 37th international ACM SIGIR conference on Research & development in information retrieval.

Brgoch J, Gaultois MW, Balasubramanian M, Page K, Hong B-C, Seshadri R. 2014. Local structure and structural rigidity of the green phosphor $\beta$-SiAlON: Eu2+. Applied Physics Letters. 105:181904.

Ishizuka H, Balents L. 2014. Magnetism in S= 1/2 double perovskites with strong spin-orbit interactions. Physical Review B. 90:184422.

Takacs CJ, Collins SD, Love JA, Mikhailovsky AA, Wynands D, Bazan GC, Nguyen T-Q, Heeger AJ. 2014. Mapping Orientational Order in a Bulk Heterojunction Solar Cell with Polarization-Dependent Photoconductive Atomic Force Microscopy. ACS nano. 8:8141–8151.

Rajan VP, Zok FW. 2014. Matrix cracking of fiber-reinforced ceramic composites in shear. Journal of the Mechanics and Physics of Solids.

Cochran JE, Junk MJN, Glaudell AM, P Miller L, Cowart JS, Toney MF, Hawker CJ, Chmelka BF, Chabinyc ML. 2014. Molecular Interactions and Ordering in Electrically Doped Polymers: Blends of PBTTT and F4TCNQ. Macromolecules. 47:6836–6846.

Düchs D, Delaney KT, Fredrickson GH. 2014. A Multi-Species Exchange Model for Fully Fluctuating Polymer Field Theory Simulations. Journal of Chemical Physics. 141(17):174103.

Douglas JE, Chater PA, Brown CM, Pollock TM, Seshadri R. 2014. Nanoscale structural heterogeneity in Ni-rich half-Heusler TiNiSn. Journal of Applied Physics. 116:163514.

Agarwal V, Peters B. 2014. Nucleation near the eutectic point in a Potts-lattice gas model. The Journal of Chemical Physics. 140:084111.

Bezzola A, Bales BB, Petzold LR, Alkire RC. 2014. Numerical Scaling Studies of Kinetically-Limited Electrochemical Nucleation and Growth with Accelerated Stochastic Simulations. Journal of The Electrochemical Society. 161:E3001–E3008.

Sela E, Jiang H-C, Gerlach MH, Trebst S. 2014. Order-by-disorder and spin-orbital liquids in a distorted Heisenberg-Kitaev model. Physical Review B. 90:035113.

Mata M, García-Cervera CJ, Ceniceros HD. 2014. Ordering kinetics of a conserved binary mixture with a nematic liquid crystal component. Journal of Non-Newtonian Fluid Mechanics. 212:18–27.

Yan Q, Janotti A, Scheffler M, Van de Walle CG. 2014. Origins of optical absorption and emission lines in AlN. Applied Physics Letters. 105:111104.

Oakley TH, Alexandrou MA, Ngo R, M Pankey S, Churchill CK, Chen W, Lopker KB. 2014. Osiris: accessible and reproducible phylogenetic and phylogenomic analyses within the Galaxy workflow management system. BMC bioinformatics. 15:230.

Bjaalie L, Himmetoglu B, Weston L, Janotti A, Van de Walle GC. 2014. Oxide interfaces for novel electronic applications. New Journal of Physics. 16:025005.

Chrétien S, Metiu H. 2014. Oxygen Adsorption on Irreducible Oxides Doped with Higher Valence Ions: O$_2$ Binding to the Dopant. J. Phys. Chem. C. 118:23070-23082.

Lugowski A, Kamil S, Buluc A, Williams S, Duriakova E, Oliker L, Fox A, Gilbert JR. 2014. Parallel processing of filtered queries in attributed semantic graphs. Journal of Parallel and Distributed Computing.

Mester Z, Lynd NA, Delaney KT, Fredrickson GH. 2014. Phase Coexistence Calculations of Reversibly Bonded Block Copolymers: A Unit Cell Gibbs Ensemble Approach. Macromolecules.

Douglas JE, Birkel CS, Verma N, Miller VM, Miao M-S, Stucky GD, Pollock TM, Seshadri R. 2014. Phase stability and property evolution of biphasic Ti–Ni–Sn alloys for use in thermoelectric applications. Journal of Applied Physics. 115:043720–043720.

M Pankey S, Minin VN, Imholte GC, Suchard MA, Oakley TH. 2014. Predictable transcriptome evolution in the convergent and complex bioluminescent organs of squid. Proceedings of the National Academy of Sciences. 111:E4736–E4742.

Botana J, Miao M-S. 2014. Pressure-stabilized lithium caesides with caesium anions beyond the- 1 state. Nature communications. 5

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Acknowledgements

Please acknowledge the CSC in publications and presentations if you are using our facilities computing resources in your research.

Use was made of computational facilities purchased with funds from the National Science Foundation (CNS-1725797) and administered by the Center for Scientific Computing (CSC). The CSC is supported by the California NanoSystems Institute and the Materials Research Science and Engineering Center (MRSEC; NSF DMR 1720256) at UC Santa Barbara.