Lambros, E., J. H. Fetherolf, S. Hammes-Schiffer, X. Li. A Many-Body Perspective of Nuclear Quantum Effects in Aqueous Clusters. J. Phys. Chem . Lett. 2024, 15, 4070-4075. DOI: 10.1021/acs.pclett.4c00439 Nuclear quantum effects play an important role in the structure and thermodynamics of aqueous...
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Smith, W.; Pouvreau, M.; Rosso, K.; Clark, A.E. pH Dependent Reactivity of Boehmite Surfaces from First-Principles Molecular Dynamics. Phys. Chem. Chem. Phys . 2022. 24(23), 14177-14186. DOI: 10.1039/D2CP00534D pH dependent interfacial chemistry depends upon the distribution and respective pKa...
Liu, A; Chow M.; Wildman, A.; Frisch, M. J.; Hammes-Schiffer, S.; Li, X. Simultaneous Optimization of Nuclear-Electronic Orbitals. J. Phys. Chem . A. 2022. 126(39), 7033-7039. DOI: 10.1021/acs.jpca.2c05172 Accurate modeling of important nuclear quantum effects, such as nuclear delocalization, zero...
Riechers, S. L.; X. Zhang; J. A. LaVerne, K. M. Rosso. Direct Measurement of Mineral Dissolution Enhanced by X-ray Irradiation. J Phys. Chem . C. 2023. 127 (36), 17694-17699. DOI: 10.1021acs.jpcc.3c02817 Developing a predictive understanding of mineral-phase stability in extreme chemical conditions...
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Reynolds, J. G.; Nienhuis, E. T.; Mergelsberg, S. T.; Pearce, C. I.; Rosso, K. M. The Apparent Reversal of the Law of Mass Action in Concentrated Multicomponent Aqueous Solutions. J Mol Liq . 2023. 377, 121470. DOI: 10.1016/j.molliq.2023.121470 Although it is well known that aqueous electrolyte...
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Ho, T. A.; Rosso, K. M.; Criscenti, L. J. Atomistic Mismatch Defines Energy−Structure Relationships during Oriented Attachment of Nanoparticles. J. Phys. Chem. Lett. 2022 . 13, 9339-9347. DOI: 10.1021/acs.jpclett.2c02511 Oriented attachment is an important crystal growth pathway in nature and has...
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A template to document AI prompts. There are four files associated with this DOI. There is a version of the template with and without examples. There is a PDF and Word copy of both versions. Please cite as: Sheridan, S. 2025. "AI Prompt Documentation Template." https://doi.org/10.17605/OSF.IO/K7FUZ...
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Created on 2025-02-03T23:25:06+00:00 by LN Anderson The Thermo Scientific™ Q Exactive HF-X Hybrid Quadrupole-Orbitrap Mass Spectrometer data source system combines a high-resolution, accurate-mass (HRAM) ultra-high-field Orbitrap mass analyzer, high capacity transfer tube with electrodynamic ion...
Coronaviruses (CoV) emerge suddenly from animal reservoirs to cause novel diseases in new hosts. Discovered in 2012, the Middle East respiratory syndrome coronavirus (MERS-CoV) is endemic in camels in the Middle East and is continually causing local outbreaks and epidemics. While all three newly...
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The ability of high-density lipoprotein (HDL) to promote cellular cholesterol efflux is a more robust predictor of cardiovascular disease protection than HDL-cholesterol levels in plasma. Previously, we found that lipidated HDL containing both apolipoprotein A-I (APOA1) and A-II (APOA2) promotes...
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Custom pipeline for relative quantification analysis of protein abundance, cysteine thiol oxidation (“Redox”), and phosphorylation (“Phospho”) experimental sample data using a semi-automated multi-PTM proteomic approach. Cite as Gluth, A., Sagendorf, T., Day, N., & Zhang, T. (2025). R. toruloides...
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Dr. Jeffrey Czajka is a Linus Pauling Fellow at Pacific Northwest National Laboratory working in the Chemical & Biological Processing Group within the Earth and Environment Directorate. Jeffrey's research is centered around fungal and yeast fermentations, where he uses machine learning and...
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Climate change is expected to increase the frequency of hotter and more intense droughts accompanied by aberrant precipitation events. Such extreme environmental shifts can trigger a complex cascade of microbial physiological responses that can impact the microbial community structure and functions...
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Please cite as: Graham E.B., and K.S. Hofmockel. 2021. "Ecological stoichiometry as a foundation for omics-enabled biogeochemical models of soil organic matter decomposition." Biogeochemistry 157. doi:10.1007/s10533-021-00851-2 Coupled biogeochemical cycles drive ecosystem ecology by influencing...
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Soil viruses are highly abundant and have important roles in the regulation of host dynamics and soil ecology. Climate change is resulting in unprecedented changes to soil ecosystems and the life forms that reside there, including viruses. In this Review, we explore our current understanding of soil...