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2014

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

Takacs CJ, Brady MA, Treat ND, Kramer EJ, Chabinyc ML. 2014. Quadrites and Crossed-Chain Crystal Structures in Polymer Semiconductors. Nano letters. 14:3096–3101.

Misch LM, Brgoch J, Birkel A, Mates TE, Stucky GD, Seshadri R. 2014. Rapid Microwave Preparation and ab Initio Studies of the Stability of the Complex Noble Metal Oxides La2BaPdO5 and La2BaPtO5. Inorganic chemistry.

Baird B, Cieslak M, Smallwood J, Grafton ST, Schooler JW. 2014. Regional White Matter Variation Associated with Domain-specific Metacognitive Accuracy.

Duff N, Dahal YRaj, Schmit JD, Peters B. 2014. Salting out the polar polymorph: Analysis by alchemical solvent transformation. Journal of Chemical Physics. 140(1):014501.

Laachi N, Delaney KT, Kim B, Hur S-M, Bristol R, Shykind D, Weinheimer CJ, Fredrickson GH. 2014. Self-consistent field theory investigation of directed self-assembly in cylindrical confinement. Journal of Polymer Science Part B: Polymer Physics.

Nazarian O, Zok FW. 2014. Shear-Dominated Plastic Behavior of a Cross-ply Dyneema® Composite. Composites Part A: Applied Science and Manufacturing.

Calusine G, Politi A, Awschalom DD. 2014. Silicon carbide photonic crystal cavities with integrated color centers. Applied Physics Letters. 105:-.

Teng Y, Otaduy MA, Madrid URJC, Kim T. 2014. Simulating Articulated Subspace Self-Contact. SIGGRAPH 2014.

Morriss-Andrews A, Shea J-E. 2014. Simulations of Protein Aggregation: Insights from Atomistic and Coarse-Grained Models. The Journal of Physical Chemistry Letters.

Zheng Y, Miao M-S, Zhang Y, Nguyen T-Q, Wudl F. 2014. Striking Effect of Intra-versus Intermolecular Hydrogen Bonding on Zwitterions: Physical and Electronic Properties. Journal of the American Chemical Society.

Krishnaswamy K, Dreyer CE, Janotti A, Van de Walle CG. 2014. Structure and energetics of LaAlO 3 (001) surfaces. Physical Review B. 90:235436.

Kim BJ, Laachi N, Delaney KT, Carilli MF, Kramer EJ, Fredrickson GH. 2014. Thermodynamic and kinetic aspects of defectivity in directed self-assembly of cylinder-forming diblock copolymers in laterally confining thin channels. Journal of Applied Polymer Science. 131(24):40790.

Fu J, Wu S, Li H, Petzold LR. 2014. The Time Dependent Propensity Function for Acceleration of Spatial Stochastic Simulation of Reaction-Diffusion Systems. Journal of Computational Physics.

Wang L, Hung H-H, Troyer M. 2014. Topological Phase Transition in the Hofstadter-Hubbard Model. arXiv preprint arXiv:1402.6704.

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.

Mullen RGotchy, Shea J-E, Peters B. 2014. Transmission coefficients, committors, and solvent coordinates in ion-pair dissociation. Journal of Chemical Theory and Computation.

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.

Bjaalie L, Janotti A, Himmetoglu B, Van de Walle CG. 2014. Turning SrTiO 3 into a Mott insulator. Physical Review B. 90:195117.

Bell S, B Jack K, Oliva P, Severen C, Walker E. 2014. Uncertainty, self-selection and the design of subsidies: Evidence from Zambia.

Speiser DI, M Pankey S, Zaharoff AK, Battelle BA, Bracken-Grissom HD, Breinholt JW, Bybee SM, Cronin TW, Garm A, Lindgren AR et al.. 2014. Using phylogenetically-informed annotation (PIA) to search for light-interacting genes in transcriptomes from non-model organisms. BMC bioinformatics. 15:350.

Janotti A, Varley JB, Choi M, Van de Walle CG. 2014. Vacancies and small polarons in SrTiO 3. Physical Review B. 90:085202.

2013

Lu B, Li Y, Wang Y, Aue DH, Luo Y, Zhang L. 2013. [3, 3]-Sigmatropic Rearrangement versus Carbene Formation in Gold-Catalyzed Transformations of Alkynyl Aryl Sulfoxides: Mechanistic Studies and Expanded Reaction Scope. Journal of the American Chemical Society. 135:8512–8524.

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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.