Publications

CSC research acknowledged in publications and presentations.

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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

2020

Dehydration entropy drives liquid-liquid phase separation by molecular crowding
Park, S., Barnes, R., Lin, Y., Jeon, B. -jin, Najafi, S., Delaney, K. T., et al. (2020). Dehydration entropy drives liquid-liquid phase separation by molecular crowding. Communications Chemistry, 3, 1\textendash12. https://doi.org/10.1038/s42004-020-0328-8
Dependence of carrier escape lifetimes on quantum barrier thickness in InGaN/GaN multiple quantum well photodetectors
Chow, Y. C., Lee, C., Wong, M. S., Wu, Y. -R., Nakamura, S., DenBaars, S. P., et al. (2020). Dependence of carrier escape lifetimes on quantum barrier thickness in InGaN/GaN multiple quantum well photodetectors. Optics Express, 28, 23796\textendash23805. https://doi.org/10.1364/OE.399924
Diffusive scaling of R\ enyi entanglement entropy
Zhou, T., & Ludwig, A. W. W. (2020). Diffusive scaling of R\ enyi entanglement entropy. Physical Review Research, 2, 033020. https://doi.org/10.1103/PhysRevResearch.2.033020
Digital design of crystalline solids
Landis, S., Zhao, Y., & Doherty, M. F. (2020). Digital design of crystalline solids. Computers \& Chemical Engineering, 133, 106637. https://doi.org/10.1016/j.compchemeng.2019.106637
Discovering hierarchies among intermetallic crystal structures
Kolli, S. K., Natarajan, A. R., Thomas, J. C., Pollock, T. M., & Van der Ven, A. (2020). Discovering hierarchies among intermetallic crystal structures. Physical Review Materials, 4, 113604. https://doi.org/10.1103/PhysRevMaterials.4.113604
Do Environmental Markets Cause Environmental Injustice? Evidence from California\textquoterights Carbon Market
Hernandez-Cortes, D., & Meng, K. C. (2020). Do Environmental Markets Cause Environmental Injustice? Evidence from California\textquoterights Carbon Market. https://doi.org/10.3386/w27205
Doping molecular organic semiconductors by diffusion from the vapor phase
Peterson, K. A., Patterson, A., Vega-Flick, A., Liao, B., & Chabinyc, M. L. (2020). Doping molecular organic semiconductors by diffusion from the vapor phase. Materials Chemistry Frontiers. https://doi.org/10.1039/D0QM00442A
First-principles calculations of hyperfine interaction, binding energy, and quadrupole coupling for shallow donors in silicon
Swift, M. W., Peelaers, H., Mu, S., Morton, J. J. L., & Van de Walle, C. G. (2020). First-principles calculations of hyperfine interaction, binding energy, and quadrupole coupling for shallow donors in silicon. Npj Computational Materials, 6, 1\textendash9. https://doi.org/10.17172/NOMAD/2020.10.21-1.
Engineering quantum-coherent defects: the role of substrate miscut in chemical vapor deposition diamond growth
Meynell, S. A., McLellan, C. A., Hughes, L. B., Mates, T., Mukherjee, K., & Jayich, A. C. B. (2020). Engineering quantum-coherent defects: the role of substrate miscut in chemical vapor deposition diamond growth. Arxiv Preprint Arxiv:2005.05866. https://doi.org/10.1063/5.0029715
Entanglement Membrane in Chaotic Many-Body Systems
Zhou, T., & Nahum, A. (2020). Entanglement Membrane in Chaotic Many-Body Systems. Physical Review X, 10, 031066. https://doi.org/10.1103/PhysRevX.10.031066
EVR-CB-004: An Inflated Hot Subdwarf O Star+ Unseen WD Companion in a Compact Binary Discovered with the Evryscope
Ratzloff, J. K., Kupfer, T., Barlow, B. N., Schneider, D., Marsh, T. R., Heber, U., et al. (2020). EVR-CB-004: An Inflated Hot Subdwarf O Star+ Unseen WD Companion in a Compact Binary Discovered with the Evryscope. The Astrophysical Journal, 902, 92. https://doi.org/10.3847/1538-4357/abb5b2
Extreme Deflection of Phase Boundaries and Chain Bridging in A (BA ) n Miktoarm Star Polymers
Lequieu, J., Koeper, T., Delaney, K. T., & Fredrickson, G. H. (2020). Extreme Deflection of Phase Boundaries and Chain Bridging in A (BA ) n Miktoarm Star Polymers. Macromolecules. https://doi.org/10.1021/acs.macromol.9b02254
The First Ultracompact Roche Lobe\textendashFilling Hot Subdwarf Binary
Kupfer, T., Bauer, E. B., Marsh, T. R., van Roestel, J., Bellm, E. C., Burdge, K. B., et al. (2020). The First Ultracompact Roche Lobe\textendashFilling Hot Subdwarf Binary. The Astrophysical Journal, 891, 45. https://doi.org/10.3847/1538-4357/ab72ff
The First Ultracompact Roche Lobe\textendashFilling Hot Subdwarf Binary
Kupfer, T., Bauer, E. B., Marsh, T. R., van Roestel, J., Bellm, E. C., Burdge, K. B., et al. (2020). The First Ultracompact Roche Lobe\textendashFilling Hot Subdwarf Binary. The Astrophysical Journal, 891, 45. https://doi.org/https://doi.org/10.3847/1538-4357/ab72ff
Frank-Read source operation in six body-centered cubic refractory metals
Xu, S., Su, Y., Smith, L. T. W., & Beyerlein, I. J. (2020). Frank-Read source operation in six body-centered cubic refractory metals. Journal Of The Mechanics And Physics Of Solids, 104017. https://doi.org/10.1016/j.jmps.2020.104017
Heightened Cold-Denaturation of Proteins at the Ice-Water Interface
Arsiccio, A., McCarty, J., Pisano, R., & Shea, J. -E. (2020). Heightened Cold-Denaturation of Proteins at the Ice-Water Interface. Journal Of The American Chemical Society. https://doi.org/10.1021/jacs.9b13454
Grafting metal complexes onto amorphous supports: from elementary steps to catalyst site populations via kernel regression
Khan, S. A., Vandervelden, C. A., Scott, S. L., & Peters, B. (2020). Grafting metal complexes onto amorphous supports: from elementary steps to catalyst site populations via kernel regression. Reaction Chemistry \& Engineering, 5, 66\textendash76. https://doi.org/10.1039/C9RE00357F
Dueling Backbones: Comparing Peptoid and Peptide Analogues of a Mussel Adhesive Protein
Wonderly, W. R., Cristiani, T. R., Cunha, K. C., Degen, G. D., Shea, J. -E., & Waite, H. (2020). Dueling Backbones: Comparing Peptoid and Peptide Analogues of a Mussel Adhesive Protein. Macromolecules, 53, 6767\textendash6779. https://doi.org/10.1021/acs.macromol.9b02715
First-principles surface energies for monoclinic Ga2O3 and Al2O3 and consequences for cracking of (Al x Ga1- x) 2O3
Mu, S., Wang, M., Peelaers, H., & Van de Walle, C. G. (2020). First-principles surface energies for monoclinic Ga2O3 and Al2O3 and consequences for cracking of (Al x Ga1- x) 2O3. Apl Materials, 8, 091105. https://doi.org/10.1063/5.0019915
First-principles study of transport in WO 3
Wang, W., Kang, Y., Peelaers, H., Krishnaswamy, K., & Van de Walle, C. G. (2020). First-principles study of transport in WO 3. Physical Review B, 101, 045116. https://doi.org/10.1103/PhysRevB.101.045116