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Related papers: A Workflow-Centric Approach to Generating FAIR Dat…

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Computational physics increasingly depends on large simulation datasets generated by software that remains under active development for many years. In such settings, reproducibility requires not only well documented data but also explicit…

Computational Physics · Physics 2026-04-30 Markus Uehlein , Tobias Held , Christopher Seibel , Lukas G. Jonda , Baerbel Rethfeld , Sebastian T. Weber

Generative AI workflows heavily rely on data-centric tasks - such as filtering samples by annotation fields, vector distances, or scores produced by custom classifiers. At the same time, computer vision datasets are quickly approaching…

Artificial Intelligence · Computer Science 2023-09-22 Daniel Kharitonov , Ryan Turner

The expansion of programmatically-accessible materials data has cultivated opportunities for data-driven approaches. Highly-automated frameworks like AFLOW not only manage the generation, storage, and dissemination of materials data, but…

Materials Science · Physics 2018-05-17 Corey Oses , Cormac Toher , Stefano Curtarolo

(Scanning) transmission electron microscopy ((S)TEM) has significantly advanced materials science but faces challenges in correlating precise atomic structure information with the functional properties of devices due to its time-intensive…

Model-free data-driven computational mechanics replaces phenomenological constitutive functions by numerical simulations based on data sets of representative samples in stress-strain space. The distance of strain and stress pairs from the…

Computational Engineering, Finance, and Science · Computer Science 2021-11-29 Kerem Ciftci , Klaus Hackl

We extend the model-free data-driven paradigm for rate-independent fracture mechanics proposed in Carrara et al. (2020), Data-driven Fracture Mechanics, Comp. Meth. App. Mech. Eng., 372 to rate-dependent fracture and sub-critical fatigue.…

Materials Science · Physics 2021-12-16 Pietro Carrara , Michael Ortiz , Laura De Lorenzis

Phase diagrams are an invaluable tool for material synthesis and provide information on the phases of the material at any given thermodynamic condition. Conventional phase diagram generation involves experimentation to provide an initial…

Advances in technology and computing hardware are enabling scientists from all areas of science to produce massive amounts of data using large-scale simulations or observational facilities. In this era of data deluge, effective coordination…

Databases · Computer Science 2015-03-31 Spyros Blanas , Surendra Byna

This document focuses on databases disseminating data on (hazardous) substances found on the North American and the European (EU) market. The goal is to analyse the FAIRness (Findability, Accessibility, Interoperability and Reusability) of…

Computers and Society · Computer Science 2024-07-23 Marcos Da Silveira , Oona Freudenthal , Louis Deladiennee

Archival research is a complicated task that involves several diverse activities for the extraction of evidence and knowledge from a set of archival documents. The involved activities are usually unconnected, in terms of data connection and…

Databases · Computer Science 2023-04-14 Pavlos Fafalios , Yannis Marketakis , Anastasia Axaridou , Yannis Tzitzikas , Martin Doerr

Evaluating the accuracy of dimensionality reduction (DR) projections in preserving the structure of high-dimensional data is crucial for reliable visual analytics. Diverse evaluation metrics targeting different structural characteristics…

Machine Learning · Computer Science 2026-01-13 Jiyeon Bae , Hyeon Jeon , Jinwook Seo

The acceleration of materials discovery requires digital platforms that go beyond data repositories to embed learning, optimization, and decision-making directly into research workflows. We introduce DataScribe, an AI-native, cloud-based…

Machine Learning · Computer Science 2026-01-14 Divyanshu Singh , Doguhan Sarıtürk , Cameron Lea , Md Shafiqul Islam , Raymundo Arroyave , Vahid Attari

The efficiency of active learning (AL) approaches to identify materials with desired properties relies on the knowledge of a few parameters describing the property. However, these parameters are unknown if the property is governed by a high…

Materials Science · Physics 2024-12-10 Akhil S. Nair , Lucas Foppa , Matthias Scheffler

Computational Fluid Dynamics (CFD) simulations are a very important tool for many industrial applications, such as aerodynamic optimization of engineering designs like cars shapes, airplanes parts etc. The output of such simulations, in…

Computer Vision and Pattern Recognition · Computer Science 2021-03-12 Theodoros Georgiou , Sebastian Schmitt , Thomas Bäck , Nan Pu , Wei Chen , Michael Lew

Sensor signals acquired in the industrial process contain rich information which can be analyzed to facilitate effective monitoring of the process, early detection of system anomalies, quick diagnosis of fault root causes, and intelligent…

Signal Processing · Electrical Eng. & Systems 2020-05-27 Feng Ye , Zhijie Xia , Min Dai , Zhisheng Zhang

The materials science community seeks to support the FAIR principles for computational simulation research. The MatCore Project was recently launched to address this need, with the goal of developing an overall metadata framework and…

Data driven approaches have the potential to make modeling complex, nonlinear physical phenomena significantly more computationally tractable. For example, computational modeling of fracture is a core challenge where machine learning…

Machine Learning · Computer Science 2025-10-01 Erfan Hamdi , Emma Lejeune

Rapid progress in additive manufacturing methods has created a new class of ultralight and strong architected metamaterials that resemble periodic truss structures. The mechanical performance of these metamaterials with a very large number…

Materials Science · Physics 2021-06-09 Angkur Jyoti Dipanka Shaikeea , Huachen Cui , Mark R. O'Masta , Xiaoyu , Zheng , Vikram S. Deshpande
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