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

2017

Strongly correlated metal built from sachdev-ye-kitaev models
Song, X. -Y., Jian, C. -M., & Balents, L. (2017). Strongly correlated metal built from sachdev-ye-kitaev models. Physical Review Letters, 119, 216601. (Original work published 11/2017 C.E.)
Sub-band-gap absorption in Ga2O3
Peelaers, H., & Van de Walle, C. G. (2017). Sub-band-gap absorption in Ga2O3. Applied Physics Letters, 111, 182104. (Original work published 10/2017 C.E.)
Suppression of thermal fluctuation placement errors in linear arrays of block copolymer cylinders
Carpenter, C. L., Delaney, K. T., & Fredrickson, G. H. (2017). Suppression of thermal fluctuation placement errors in linear arrays of block copolymer cylinders. Presented at the. International Society for Optics and Photonics. (Original work published 03/2017 C.E.)
Switchable Plasmonic\textendashDielectric Resonators with Metal\textendashInsulator Transitions
Butakov, N. A., Valmianski, I., Lewi, T., Urban, C., Ren, Z., Mikhailovsky, A. A., et al. (2017). Switchable Plasmonic\textendashDielectric Resonators with Metal\textendashInsulator Transitions. Acs Photonics. (Original work published 10/2017 C.E.)
Synthesis of a versatile pentacyclic building block for organic electronics
McDearmon, B., Lim, E., O\textquoterightHara, K., Nakayama, H., Luo, Y., Chabinyc, M. L., & Hawker, C. J. (2017). Synthesis of a versatile pentacyclic building block for organic electronics. Journal Of Polymer Science Part A: Polymer Chemistry, 55, 2618\textendash2628. https://doi.org/10.1002/pola.28656 (Original work published 06/2017 C.E.)
Theory of polyelectrolyte complexation\textemdashComplex coacervates are self-coacervates
Delaney, K. T., & Fredrickson, G. H. (2017). Theory of polyelectrolyte complexation\textemdashComplex coacervates are self-coacervates. The Journal Of Chemical Physics, 146, 224902. https://doi.org/10.1063/1.4985568 (Original work published 06/2017 C.E.)
Tuning the magnetocaloric response in half-Heusler/Heusler MnNi 1+ x Sb solid solutions
Levin, E. E., Bocarsly, J. D., Wyckoff, K. E., Pollock, T. M., & Seshadri, R. (2017). Tuning the magnetocaloric response in half-Heusler/Heusler MnNi 1+ x Sb solid solutions. Physical Review Materials, 1, 075003. (Original work published 12/2017 C.E.)
Ultrawide thermal free-carrier tuning of dielectric antennas coupled to epsilon-near-zero substrates
Iyer, P. P., Pendharkar, M., Palmstr\om, C. J., & Schuller, J. A. (2017). Ultrawide thermal free-carrier tuning of dielectric antennas coupled to epsilon-near-zero substrates. Nature Communications, 8, 472. (Original work published 09/2017 C.E.)
Ultrawide thermo-optic tuning of PbTe meta-atoms
Lewi, T., Evans, H. A., Butakov, N. A., & Schuller, J. A. (2017). Ultrawide thermo-optic tuning of PbTe meta-atoms. Nano Letters, 17, 3940\textendash3945. (Original work published 05/2017 C.E.)
Ultrawide Thermo-Optic Tuning of PbTe Meta-atoms
Lewi, T., Evans, H. A., Butakov, N. A., & Schuller, J. A. (2017). Ultrawide Thermo-Optic Tuning of PbTe Meta-atoms. Nano Letters. https://doi.org/10.1021/acs.nanolett.7b01529 (Original work published 05/2017 C.E.)
A unified description of ordering in HCP Mg-RE alloys
Natarajan, A. R., & Van der Ven, A. (2017). A unified description of ordering in HCP Mg-RE alloys. Acta Materialia, 124, 620\textendash632. https://doi.org/10.1016/j.actamat.2016.10.057 (Original work published 02/2017 C.E.)
Unraveling Hydrophobic Interactions at the Molecular Scale Using Force Spectroscopy and Molecular Dynamics Simulations
Stock, P., Monroe, J. I., Utzig, T., Smith, D. J., Shell, S., & Valtiner, M. (2017). Unraveling Hydrophobic Interactions at the Molecular Scale Using Force Spectroscopy and Molecular Dynamics Simulations. Acs Nano, 11, 2586\textendash2597. https://doi.org/10.1021/acsnano.6b06360 (Original work published 03/2017 C.E.)
Which is the Stronger Nucleophile, Platinum or Nitrogen in Rollover Cycloplatinated (II) Complexes?
Hosseini, F. N., Nabavizadeh, M., & Abu-Omar, M. M. (2017). Which is the Stronger Nucleophile, Platinum or Nitrogen in Rollover Cycloplatinated (II) Complexes?. Inorganic Chemistry, 56, 14706\textendash14713. (Original work published 11/2017 C.E.)

2016

Adhesion and detachment of a capsule in axisymmetric flow
Keh, M. P., & Leal, L. G. (2016). Adhesion and detachment of a capsule in axisymmetric flow. Physical Review Fluids, 1, 013201. https://doi.org/10.1103/PhysRevFluids.1.013201 (Original work published 05/2016 C.E.)
Aggregation of Chameleon Peptides: Implications of $\alpha$-Helicity in Fibril Formation
Kim, B., Do, T. D., Hayden, E. Y., Teplow, D. B., Bowers, M. T., & Shea, J. -E. (2016). Aggregation of Chameleon Peptides: Implications of $\alpha$-Helicity in Fibril Formation. Journal Of Physical Chemistry B, 120, 5874-5883. https://doi.org/10.1021/acs.jpcb.6b00830 (Original work published 07/2016 C.E.)
Amyloid $\beta$-Protein C-terminal Fragments: Formation of Cylindrins and $\beta$-barrels
Do, T. D., LaPointe, N. E., Nelson, R., Krotee, P., Hayden, E. Y., Ulrich, B., et al. (2016). Amyloid $\beta$-Protein C-terminal Fragments: Formation of Cylindrins and $\beta$-barrels. Journal Of The American Chemical Society, 138, 549\textendash557. https://doi.org/10.1021/jacs.5b09536 (Original work published 01/2016 C.E.)
Analysis of the Amyloidogenic Potential of Pufferfish (Takifugu rubripes) Islet Amyloid Polypeptide Highlights the Limitations of Thioflavin-T Assays and the Difficulties in Defining Amyloidogenicity
Wong, A. G., Wu, C., Hannaberry, E., Watson, M. D., Shea, J. -E., & Raleigh, D. P. (2016). Analysis of the Amyloidogenic Potential of Pufferfish (Takifugu rubripes) Islet Amyloid Polypeptide Highlights the Limitations of Thioflavin-T Assays and the Difficulties in Defining Amyloidogenicity. Biochemistry, 55, 510\textendash518. https://doi.org/10.1021/acs.biochem.5b01107 (Original work published 01/2016 C.E.)
Band alignments between SmTiO3, GdTiO3, and SrTiO3
Bjaalie, L., Azcatl, A., McDonnell, S., Freeze, C. R., Stemmer, S., Wallace, R. M., & Van de Walle, C. G. (2016). Band alignments between SmTiO3, GdTiO3, and SrTiO3. Journal Of Vacuum Science \& Technology A, 34, 061102. https://doi.org/10.1116/1.4963833 (Original work published 11/2016 C.E.)
BaSnO3 as a channel material in perovskite oxide heterostructures
Krishnaswamy, K., Bjaalie, L., Himmetoglu, B., Janotti, A., Gordon, L., & Van de Walle, C. G. (2016). BaSnO3 as a channel material in perovskite oxide heterostructures. Applied Physics Letters, 108, 083501. https://doi.org/10.1063/1.4942366 (Original work published 02/2016 C.E.)
Computational analysis of fitness landscapes and evolutionary networks from in vitro evolution experiments
Xulvi-Brunet, R., Campbell, G. W., Rajamani, S., enez, J. \ e I. J. \, & Chen, I. A. (2016). Computational analysis of fitness landscapes and evolutionary networks from in vitro evolution experiments. Methods, 106, 86-96. https://doi.org/10.1016/j.ymeth.2016.05.012 (Original work published 08/2016 C.E.)