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

2022

Enabling a low-carbon electricity system for Southern Africa
Chowdhury, A. F. M. K., Deshmukh, R., Wu, G. C., Uppal, A., Mileva, A., Curry, T., et al. (2022). Enabling a low-carbon electricity system for Southern Africa. Joule, 6, 1826\textendash1844.
Enantioselective Dearomative Cyclization Enabled by Asymmetric Cooperative Gold Catalysis
Zhao, K., Kohnke, P., Yang, Z., Cheng, X., You, S. -L., & Zhang, L. (2022). Enantioselective Dearomative Cyclization Enabled by Asymmetric Cooperative Gold Catalysis. Angewandte Chemie International Edition, 61, e202207518.
Energetically favorable dislocation/nanobubble bypass mechanism in irradiation conditions
Jian, W. -R., Xu, S., Su, Y., & Beyerlein, I. J. (2022). Energetically favorable dislocation/nanobubble bypass mechanism in irradiation conditions. Acta Materialia, 117849.
Experimental Realization of the Kicked Aubry-Andr\ e-Harper Hamiltonian
Shimasaki, T., Kondakci, E., Prichard, M., Pagett, J., Bai, Y., Dotti, P., et al. (2022). Experimental Realization of the Kicked Aubry-Andr\ e-Harper Hamiltonian. Presented at the. Optica Publishing Group.
Magnetohydrodynamic simulations of AM CVn accretion disks
Oyang, B. (2022). Magnetohydrodynamic simulations of AM CVn accretion disks.
Metagenomic methylation patterns resolve bacterial genomes of unusual size and structural complexity
Wilbanks, E. G., e, H. D. \, Ashby, M. H., Heiner, C., Roberts, R. J., & Eisen, J. A. (2022). Metagenomic methylation patterns resolve bacterial genomes of unusual size and structural complexity. The Isme Journal, 1\textendash11.
Exaggerated trans-membrane charge of ammonium transporters in nutrient-poor marine environments
Kellom, M., Pagliara, S., Richards, T. A., & Santoro, A. E. (2022). Exaggerated trans-membrane charge of ammonium transporters in nutrient-poor marine environments. Open Biology, 12, 220041.
A machine learning model to predict yield surfaces from crystal plasticity simulations
Nascimento, A. W. P. do, Roongta, S., Diehl, M., & Beyerlein, I. J. (2022). A machine learning model to predict yield surfaces from crystal plasticity simulations. International Journal Of Plasticity, 103507.
Machine Learning and Polymer Self-Consistent Field Theory in Two Spatial Dimensions
Xuan, Y., Delaney, K. T., Ceniceros, H. D., & Fredrickson, G. H. (2022). Machine Learning and Polymer Self-Consistent Field Theory in Two Spatial Dimensions. Arxiv Preprint Arxiv:2212.10478.
Line-length-dependent dislocation glide in refractory multi-principal element alloys
Xu, S., Jian, W. -R., Su, Y., & Beyerlein, I. J. (2022). Line-length-dependent dislocation glide in refractory multi-principal element alloys. Applied Physics Letters, 120, 061901.
Lewis acid\textendashbase pair doping of p-type organic semiconductors
Peterson, K. A., & Chabinyc, M. L. (2022). Lewis acid\textendashbase pair doping of p-type organic semiconductors. Journal Of Materials Chemistry C, 10, 6287\textendash6295.
Layered Hybrid Lead Iodide Perovskites with Short Interlayer Distances
Mao, L., Morgan, E. E., Li, A., Kennard, R. M., Hong, M. J., Liu, Y., et al. (2022). Layered Hybrid Lead Iodide Perovskites with Short Interlayer Distances. Acs Energy Letters, 7, 2801\textendash2806.
Lattice Dynamics in the NASICON NaZr2 (PO4) 3 Solid Electrolyte from Temperature-Dependent Neutron Diffraction, NMR, and Ab Initio Computational Studies
Morgan, E. E., Evans, H. A., Pilar, K., Brown, C. M., ement, R. ele J. C. \, Maezono, R., et al. (2022). Lattice Dynamics in the NASICON NaZr2 (PO4) 3 Solid Electrolyte from Temperature-Dependent Neutron Diffraction, NMR, and Ab Initio Computational Studies. Chemistry Of Materials.
Joint Asymptotic Closed-Loop Design of Secondary Transform and Scan Order for Inter Coding in AV1
Sivakumar, K. K., Vishwanath, B., & Rose, K. (2022). Joint Asymptotic Closed-Loop Design of Secondary Transform and Scan Order for Inter Coding in AV1. Presented at the. IEEE.
Investigation of the Self-Assembly Behavior of Statistical Bottlebrush Copolymers via Self-Consistent Field Theory Simulations
Chen, D., Quah, T., Delaney, K. T., & Fredrickson, G. H. (2022). Investigation of the Self-Assembly Behavior of Statistical Bottlebrush Copolymers via Self-Consistent Field Theory Simulations. Macromolecules.
Inverse Design of Pore Wall Chemistry To Control Solute Transport and Selectivity
Jiao, S., Katz, L. E., & Shell, S. (2022). Inverse Design of Pore Wall Chemistry To Control Solute Transport and Selectivity. Acs Central Science, 8, 1609\textendash1617.
Interfacial reaction-induced roughening in polymer thin films
Sengupta, R., Tikekar, M. D., Delaney, K. T., Villet, M. C., & Fredrickson, G. H. (2022). Interfacial reaction-induced roughening in polymer thin films. Soft Matter.
Integrated single-cell sequencing reveals principles of epigenetic regulation of human gastrulation and germ cell development in a 3D organoid model
Chialastri, A., Karzbrun, E., Khankhel, A. H., Radeke, M. J., Streichan, S. J., & Dey, S. S. (2022). Integrated single-cell sequencing reveals principles of epigenetic regulation of human gastrulation and germ cell development in a 3D organoid model. Biorxiv.
Field-Theoretic Simulations of Fully-Fluctuating Spin Lattices at Finite Temperature
McGarrigle, E., Delaney, K., Balents, L., Orland, H., & Fredrickson, G. (2022). Field-Theoretic Simulations of Fully-Fluctuating Spin Lattices at Finite Temperature. Bulletin Of The American Physical Society.
Ferroelectric HfO 2 and the importance of strain
Behara, S. S., & Van der Ven, A. (2022). Ferroelectric HfO 2 and the importance of strain. Physical Review Materials, 6, 054403.