Publications

CSC research acknowledged in publications and presentations.

Please remember to continue to acknowledge the use of CSC resources with

 

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 2308708) at UC Santa Barbara.

Selected Publications

2018

Tension-compression asymmetry in plasticity of nanotwinned 3C-SiC nanocrystals
Chavoshi, S. Z., & Xu, S. (2018). Tension-compression asymmetry in plasticity of nanotwinned 3C-SiC nanocrystals. Journal Of Applied Physics, 124, 095103. https://doi.org/https://doi.org/10.1063/1.5046949
Thermal tuning capabilities of semiconductor metasurface resonators
Lewi, T., Butakov, N. A., & Schuller, J. A. (2018). Thermal tuning capabilities of semiconductor metasurface resonators. Arxiv, Optics, 1-18. (Original work published 02/18 C.E.)
Topological Methods for Polymeric Materials: Characterizing the
Panagiotou, E., Millett, K., & Atzberger, P. J. (2018). Topological Methods for Polymeric Materials: Characterizing the. (Original work published 01/2018 C.E.)
Towards All-digital mmWave Massive MIMO: Designing around Nonlinearities
Abdelghany, M., Farid, A. A., Madhow, U., & Rodwell, M. J. W. (2018). Towards All-digital mmWave Massive MIMO: Designing around Nonlinearities. Presented at the. https://doi.org/10.1109/ACSSC.2018.8645214 (Original work published Oct)
Twinning effects in the single/nanocrystalline cubic silicon carbide subjected to nanoindentation loading
Chavoshi, S. Z., & Xu, S. (2018). Twinning effects in the single/nanocrystalline cubic silicon carbide subjected to nanoindentation loading. Materialia, 3, 304\textendash325. https://doi.org/https://doi.org/10.1016/j.mtla.2018.09.003
Ultralow thermal conductivity in a two-dimensional material due to surface-enhanced resonant bonding
Yue, S. -Y., Xu, T., & Liao, B. (2018). Ultralow thermal conductivity in a two-dimensional material due to surface-enhanced resonant bonding. Materials Today Physics, 7, 89\textendash95. https://doi.org/https://doi.org/10.1016/j.mtphys.2018.11.005

2017

1,2,3,4,6-penta-O-galloyl-β-d-glucopyranose binds to the N-terminal metal binding region to inhibit amyloid β-protein oligomer and fibril formation
de Almeida, N. \ alia E. C., Do, T. D., LaPointe, N. E., Tro, M., Feinstein, S. C., Shea, J. -E., & Bowers, M. T. (2017). 1,2,3,4,6-penta-O-galloyl-β-d-glucopyranose binds to the N-terminal metal binding region to inhibit amyloid β-protein oligomer and fibril formation. International Journal Of Mass Spectrometry, 420. https://doi.org/10.1016/j.ijms.2016.09.018 (Original work published 09/2017 C.E.)
Acceptor doping in the proton conductor SrZrO 3
Weston, L., Janotti, A., Cui, X. Y., Stampfl, C., & Van de Walle, C. G. (2017). Acceptor doping in the proton conductor SrZrO 3. Physical Chemistry Chemical Physics, 19, 11485\textendash11491. https://doi.org/10.1039/C7CP01471F (Original work published 04/2017 C.E.)
Analysis of in vitro evolution reveals the underlying distribution of catalytic activity among random sequences
Pressman, A., Moretti, J. E., Campbell, G. W., Müller, U. F., & Chen, I. A. (2017). Analysis of in vitro evolution reveals the underlying distribution of catalytic activity among random sequences. Nucleic Acids Research. https://doi.org/10.1093/nar/gkx540 (Original work published 08/2017 C.E.)
The Application of Computational Chemistry to Problems in Mass Spectrometry
Aue, D. B. D. H. (2017). The Application of Computational Chemistry to Problems in Mass Spectrometry. (Original work published 05/2017 C.E.)
Architecture and coevolution of allosteric materials
Yan, L., Ravasio, R., Brito, C., & Wyart, M. (2017). Architecture and coevolution of allosteric materials. Proceedings Of The National Academy Of Sciences, 201615536. https://doi.org/10.1073/pnas.1615536114 (Original work published 03/2017 C.E.)
Biological Thiols and Carbon Disulfide: The Formation and Decay of Trithiocarbonates under Physiologically Relevant Conditions
Souza, M. L., DeMartino, A. W., & Ford, P. C. (2017). Biological Thiols and Carbon Disulfide: The Formation and Decay of Trithiocarbonates under Physiologically Relevant Conditions. Acs Omega, 2, 6535\textendash6543. (Original work published 10/2017 C.E.)
Borrowing Constraints, Search, and Life-Cycle Inequality
Griffy, B. (2017). Borrowing Constraints, Search, and Life-Cycle Inequality. (Original work published 11/2017 C.E.)
Catalytic molten metals for the direct conversion of methane to hydrogen and separable carbon
Upham, C., Agarwal, V., Khechfe, A., Snodgrass, Z. R., Gordon, M. J., Metiu, H., & McFarland, E. W. (2017). Catalytic molten metals for the direct conversion of methane to hydrogen and separable carbon. Science, 358, 917\textendash921. (Original work published 11/2017 C.E.)
A cohort of new adhesive proteins identified from transcriptomic analysis of mussel foot glands
DeMartini, D. G., Errico, J. M., Sjoestroem, S., Fenster, A., & Waite, H. (2017). A cohort of new adhesive proteins identified from transcriptomic analysis of mussel foot glands. Journal Of The Royal Society Interface, 14, 20170151. https://doi.org/10.1098/rsif.2017.0151 (Original work published 06/2017 C.E.)
Colorful seashells: Identification of haem pathway genes associated with the synthesis of porphyrin shell color in marine snails
Williams, S. T., Lockyer, A. E., Dyal, P., Nakano, T., Churchill, C. K. C., & Speiser, D. I. (2017). Colorful seashells: Identification of haem pathway genes associated with the synthesis of porphyrin shell color in marine snails. Ecology And Evolution, 7, 10379\textendash10397. (Original work published 10/2017 C.E.)
Computationally predicted energies and properties of defects in GaN
Lyons, J. L., & Van de Walle, C. G. (2017). Computationally predicted energies and properties of defects in GaN. Npj Computational Materials, 3, 1. https://doi.org/10.1038/s41524-017-0014-2 (Original work published 03/2017 C.E.)
Controlling n-Type Doping in MoO3
Peelaers, H., Chabinyc, M. L., & Van de Walle, C. G. (2017). Controlling n-Type Doping in MoO3. Chemistry Of Materials, 29, 2563\textendash2567. https://doi.org/10.1021/acs.chemmater.6b04479 (Original work published 02/2017 C.E.)
Convection Affects Magnetic Turbulence in White Dwarf Accretion Disks
Coleman, M. S. B. (2017). Convection Affects Magnetic Turbulence in White Dwarf Accretion Disks. (Original work published 06/2017 C.E.)
Convective quenching of field reversals in accretion disc dynamos
Coleman, M. S. B., Yerger, E., Blaes, O., Salvesen, G., & Hirose, S. (2017). Convective quenching of field reversals in accretion disc dynamos. Monthly Notices Of The Royal Astronomical Society, 467, 2625\textendash2635. https://doi.org/10.1093/mnras/stx268 (Original work published 02/2017 C.E.)