Selected Publications

2025

Oxygen impurities in AlN and their impact on optical absorption
Yan, Q., Lyons, J. L., Gordon, L., Janotti, A., & Van de Walle, C. G. (2025). Oxygen impurities in AlN and their impact on optical absorption. Applied Physics Letters, 126.
Ejecta Wakes from Companion Interaction in Type Ia Supernova Remnants
Prust, L., Kumar, G., & Bildsten, L. (2025). Ejecta Wakes from Companion Interaction in Type Ia Supernova Remnants. The Astrophysical Journal, 982, 60.
Impact of Subsurface Oxygen on CO2 Charging Energy Changes in Cu Surfaces
Lei, X., & Vlcek, V. (2025). Impact of Subsurface Oxygen on CO2 Charging Energy Changes in Cu Surfaces. The Journal Of Physical Chemistry Letters, 16, 1126-1133.
Estimating the Footprint of Artisanal Mining in Africa
Christensen, D., Carleton, T., Rolf, E., Molitor, C., Biswas, S., Yan, K., & Blair, G. (2025). Estimating the Footprint of Artisanal Mining in Africa.
Universal Phase Identification of Block Copolymers From Physics-Informed Machine Learning
Fang, X., Murphy, E. A., Kohl, P., Li, Y., Hawker, C. J., Bates, C. M., & Gu, M. (2025). Universal Phase Identification of Block Copolymers From Physics-Informed Machine Learning. Journal Of Polymer Science.
10.4\% external quantum efficiency 294 nm UV LEDs at 20 A/cm2 with a fully transparent tunnel junction
Wang, M., Gong, W., Wu, F., DenBaars, S. P., Nakamura, S., & Speck, J. S. (2025). 10.4\% external quantum efficiency 294 nm UV LEDs at 20 A/cm2 with a fully transparent tunnel junction. Optics Express, 33, 19876-19884.
First-Principles Statistical Mechanics Study of Magnetic Fluctuations and Order—Disorder in the Spinel LiNi0. 5Mn1. 5O4 Cathode
Ponte, G., Behara, S. S., Bassey, E., ement, R. ele J. C. \, & Van der Ven, A. (2025). First-Principles Statistical Mechanics Study of Magnetic Fluctuations and Order—Disorder in the Spinel LiNi0. 5Mn1. 5O4 Cathode. Chemistry Of Materials, 37, 1835-1846.
Catalytic Enantioselective Smiles Rearrangement Enabled by the Directed Evolution of P450 Radical Aryl Migratases
Fu, W., Murcek, K., Chen, J., Liu, A., Zhao, Y., Liu, P., & Yang, Y. (2025). Catalytic Enantioselective Smiles Rearrangement Enabled by the Directed Evolution of P450 Radical Aryl Migratases. Journal Of The American Chemical Society, 147, 12197-12205.
stagg:: A data pre-processing R package for climate impacts analysis
Liddell, T., Boser, A., Orofino, S., Mangin, T., & Carleton, T. (2025). stagg:: A data pre-processing R package for climate impacts analysis. Environmental Modelling \& Software, 183, 106202.
Functional characterization of luciferase in a brittle star indicates parallel evolution influenced by genomic availability of haloalkane dehalogenase
Lau, E., Majerova, M., Hensley, N., Mukherjee, A., Vasina, M., Pluskal, D., et al. (2025). Functional characterization of luciferase in a brittle star indicates parallel evolution influenced by genomic availability of haloalkane dehalogenase. Molecular Biology And Evolution, 42, msaf081.
Enhanced Degradation of Vinyl Copolymers Based on Lipoic Acid
Okayama, Y., Morris, P., Albanese, K., Olsen, S., Mori, A., de Alaniz, J. R., et al. (2025). Enhanced Degradation of Vinyl Copolymers Based on Lipoic Acid. Journal Of Polymer Science.
De novo design of porphyrin-containing proteins as efficient and stereoselective catalysts
Hou, K., Huang, W., Qi, M., Tugwell, T., Alturaifi, T., Chen, Y., et al. (2025). De novo design of porphyrin-containing proteins as efficient and stereoselective catalysts. Science, 388, 665-670.
Predicting the solvent effect on crystal morphology via quantum mechanical methods
Zhao, Y., Gee, R., & Doherty, M. F. (2025). Predicting the solvent effect on crystal morphology via quantum mechanical methods. Aiche Journal, e18766.
Geometry-Assisted Phase Selection: Interplay of Phase Heterogeneity and Geometry in Gyroid Shell Metamaterials Printed with 17-4 PH Stainless Steel
Pürstl, J., Fields, B., Ziemke, P., Ventura, N. \, Ainger, K., Apelian, D., et al. (2025). Geometry-Assisted Phase Selection: Interplay of Phase Heterogeneity and Geometry in Gyroid Shell Metamaterials Printed with 17-4 PH Stainless Steel. Advanced Engineering Materials, 2402309.
Noise-augmented chaotic Ising machines for combinatorial optimization and sampling
Lee, K., Chowdhury, S., & Camsari, K. Y. (2025). Noise-augmented chaotic Ising machines for combinatorial optimization and sampling. Communications Physics, 8, 35.
A versatile machine learning workflow for high-throughput analysis of supported metal catalyst particles
Genc, A., Marlowe, J., Jalil, A., Belzberg, D., Kovarik, L., & Christopher, P. (2025). A versatile machine learning workflow for high-throughput analysis of supported metal catalyst particles. Ultramicroscopy, 271, 114116.
Telechelic Dithiol Copolymers as Tunable Building Blocks for Synthesizing Multiblock Materials
Czuczola, M., Hossain, M., Shannon, D., Morris, P., Getty, P., Bates, C. M., et al. (2025). Telechelic Dithiol Copolymers as Tunable Building Blocks for Synthesizing Multiblock Materials. Journal Of Polymer Science, 63, 759-765.
Enantioselective Annulation Reactions Enabled by Chiral Lithium Amides as Traceless Auxiliaries
Lu, L., Sepetov, L., Purcell, L., Park, J., Pan, P., Yu, K., & Zakarian, A. (2025). Enantioselective Annulation Reactions Enabled by Chiral Lithium Amides as Traceless Auxiliaries. Organic Letters.
Context Dependency of Hydrophobicity in Intrinsically Disordered Proteins: Insights from a New Dewetting Free Energy-Based Hydrophobicity Scale
Najafi, S., Lobo, S., Shell, S., & Shea, J. -E. (2025). Context Dependency of Hydrophobicity in Intrinsically Disordered Proteins: Insights from a New Dewetting Free Energy-Based Hydrophobicity Scale. The Journal Of Physical Chemistry B.
Functional characterization of luciferase in a brittle star indicates parallel evolution influenced by genomic availability of haloalkane dehalogenase
Lau, E., Majerova, M., Hensley, N., Mukherjee, A., Vasina, M., Pluskal, D., et al. (2025). Functional characterization of luciferase in a brittle star indicates parallel evolution influenced by genomic availability of haloalkane dehalogenase. Molecular Biology And Evolution, 42, msaf081.