7 papers · ranked by Valyu relevance
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Iron, the most abundant element on Earth by mass (34.6%), primarily exists as iron minerals due to its inherent reactivity. The study of iron mineral phase transformations under changing environmental conditions remains an important research focus due to its geological, environmental, and industrial significance. Yet…
Shadrack Barnabas, Timo Böhme, Stephen Boyer, Matthias Irmer + 4 more
The extraction of chemical information from documents is a demanding task in cheminformatics due to the variety of text and image-based representations of chemistry. The present work describes the extraction of chemical compounds with unique chemical structures from the open access CORE (COnnecting REpositories) and…
Shadrack Barnabas, Timo Böhme, Stephen Boyer, Matthias Irmer + 5 more
The extraction of chemical information from documents is a demanding task in cheminformatics due to the variety of text and image-based representations of chemistry. The present work describes the extraction of chemical compounds with unique chemical structures from the open access CORE (COnnecting REpositories) and…
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The scarcity and expense of fatigue data limits optimal design of components and constrains companies to a few well qualified materials when safety-critical applications are concerned. This research investigates different strategies to improve extraction of structured information from unstructured scientific…
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The materials-science literature is the richest reservoir of domain knowledge, yet converting its unstructured text—especially narrative passages and complex tables—into machine-readable data for analysis and ML model training remains challenging. To address this, we present KnowMat, an agentic, multi-stage pipeline…
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Meteorological normalization is a key concept in studying anthropogenic effects on air pollutant concentrations and its temporal trends. While apparently successful in revealing anthropogenic effects and often used, there are downsides to the methods and limitations which should be taken into account when using it.…
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Accelerating computational materials science relies not only on hardware advances but also on software that increases the ease of working with the relevant abstractions. Creation and manipulation of crystal structures is a part of many routine materials science workflows. In this work, we demonstrate how fine tuning…