Publications

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2022

Mu S, Wang M, Varley JB, Lyons JL, Wickramaratne D, Van de Walle CG. 2022. Role of carbon and hydrogen in limiting n-type doping of monoclinic (AlxGa1−x)2O3. Physical Review B. 105:155201.

Jian W-R, Xu S, Su Y, Beyerlein IJ. 2022. Role of layer thickness and dislocation distribution in confined layer slip in nanolaminated Nb. International Journal of Plasticity. 152:103239.

2021

Blaes O. 2021. Radiative MHD simulations of photon bubbles in radiation-supported magnetized atmospheres of neutron stars with isotropic Thomson scattering. Monthly Notices of the Royal Astronomical Society. 508:617–636.

Oh S, Nikolaev A, Tagami K, Tran T, Lee D, Mukherjee S, Segalman RA, Han S, de Alaniz JRead, Chabinyc ML. 2021. Redox-Active Polymeric Ionic Liquids with Pendant N-Substituted Phenothiazine. ACS Applied Materials & Interfaces. 13:5319–5326.

Barrett JA, Li Z, Garcia JV, Wein E, Zheng D, Hunt C, Ngo L, Sepunaru L, Iretskii AV, Ford PC. 2021. Redox-mediated carbon monoxide release from a manganese carbonyl—implications for physiological CO delivery by CO releasing moieties. Royal Society open science. 8:211022.

Hanemann-Rawlings DT. 2021. The Role of Ionic Interactions on Structure and Transport in Conjugated Polymeric Mixed Conductors.

Jian W-R, Wang L, Bi W, Xu S, Beyerlein IJ. 2021. Role of local chemical fluctuations in the melting of medium entropy alloy CoCrNi. Applied Physics Letters. 119:121904.

2020

Kamei T, Kamikawa T, Araki M, DenBaars SP, Nakamura S, Bowers JE. 2020. Research Toward a Heterogeneously Integrated InGaN Laser on Silicon. physica status solidi (a). 217:1900770.

Klemenz S, Hay AK, Teicher SML, Topp A, Cano J, Schoop LM. 2020. The role of delocalized chemical bonding in square-net-based topological semimetals. Journal of the American Chemical Society.

Spjut RWilliam. 2020. Roots and Critical Points of Complex Polynomials: Applications of Algorithms in Real Algebra, Moment Theory, Convex Analysis, Optimization, and Positive Polynomials to a Conjecture in Pure Mathematics.

2019

Agarwal V, Metiu H. 2019. Rates of adsorption and desorption: Entropic contributions and errors due to mean-field approximations. The Journal of chemical physics. 150:184702.

Lewi T, Butakov NA, Iyer PP, Evans HA, Higgs D, Chorsi H, Trastoy J, Granda JDel Valle, Valmianski I, Urban C et al.. 2019. Reconfigurable semiconductor Mie-resonant meta-optics. Metamaterials, Metadevices, and Metasystems 2019.

2018

Goiri J.G, Van der Ven A.. 2018. Recursive alloy Hamiltonian construction and its application to the Ni-Al-Cr system. Acta Materialia.

2017

Bradley D, Conklin E, Papastamatiou YP, McCauley DJ, Pollock K, Pollock A, Kendall BE, Gaines SD, Caselle JE. 2017. Resetting predator baselines in coral reef ecosystems. Scientific Reports. 7

Lamontagne LK, Laurita G, Knight M, Yusuf H, Hu J, Seshadri R, Page K. 2017. The Role of Structural and Compositional Heterogeneities in the Insulator-to-Metal Transition in Hole-Doped APd3O4 (A= Ca, Sr). Inorganic Chemistry. 56:5158–5164.

2016

Huang C, Kristoffersen HH, Gong X-Q, Metiu H. 2016. Reactions of Molten LiI with I2, H2O, and O2 Relevant to Halogen-Mediated Oxidative Dehydrogenation of Alkanes. Journal of Physical Chemistry C. 120(9):4931–4936.

Delaney KT, Fredrickson GH. 2016. Recent Developments in Fully Fluctuating Field-Theoretic Simulations of Polymer Melts and Solutions. Journal of Physical Chemistry B. 120(31):7615-7634.

Wang W, Janotti A, Van de Walle CG. 2016. Role of oxygen vacancies in crystalline WO 3. Journal of Materials Chemistry C.

2015

Iyer PP, Butakov NA, Schuller JA. 2015. Reconfigurable Semiconductor Phased-Array Metasurfaces. ACS Photonics.

Kristoffersen HH, Metiu H. 2015. Reconstruction of Low-Index $\alpha$-V2O5 Surfaces. The Journal of Physical Chemistry C.

Mikhnenko OV, Collins SD, Nguyen T-Q. 2015. Rectifying Electrical Noise with an Ionic-Organic Ratchet. Advanced Materials. 27:2007–2012.

Levine ZA, Larini L, LaPointe NE, Feinstein SC, Shea J-E. 2015. Regulation and aggregation of intrinsically disordered peptides. Proceedings of the National Academy of Sciences. 112:2758–2763.

Rhein RK, Dodge PC, Chen M-H, Titus MS, Pollock TM, Van der Ven A. 2015. Role of vibrational and configurational excitations in stabilizing the L 1 2 structure in Co-rich Co-Al-W alloys. Physical Review B. 92:174117.

2014

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.

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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.