Results 211 to 220 of about 50,851 (256)

Harnessing Machine Learning to Understand and Design Disordered Solids

Advanced Intelligent Discovery, EarlyView.
This review maps the dynamic evolution of machine learning in disordered solids, from structural representations to generative modeling. It explores how deep learning and model explainability transform property prediction into profound physical insight.
Muchen Wang, Yue Fan
wiley   +1 more source

The Interoperability Challenge in DFT Workflows Across Implementations

Advanced Intelligent Discovery, EarlyView.
Interoperability and cross‐validation remain major challenges in the computational materials science. In this work, we introduce a common input/output standard that enables internal translation across multiple workflow managers—AiiDA, PerQueue, Pipeline Pilot, and SimStack—while producing results in a unified schema.
Simon K. Steensen, Tushar Singh Thakur, Manuel Dillenz, Johan M. Carlsson, Celso R. C. Rêgo, Eibar Flores, Hamidreza Hajiyani, Felix Hanke, Juan María García Lastra, Wolfgang Wenzel, Nicola Marzari, Tejs Vegge, Giovanni Pizzi, Ivano E. Castelli   +13 more
wiley   +1 more source

Construction Methods of Mesoscopic Models for Concrete and Quantitative Analysis of Mesoscopic Damage. [PDF]

Materials (Basel)
Wang X, Li S, Chen Y, Ma S, Chen J.
europepmc   +1 more source

AI‐Guided Co‐Optimization of Advanced Field‐Effect Transistors: Bridging Material, Device, and Fabrication Design

Advanced Intelligent Discovery, EarlyView.
This article outlines how artificial intelligence could reshape the design of next‐generation transistors as traditional scaling reaches its limits. It discusses emerging roles of machine learning across materials selection, device modeling, and fabrication processes, and highlights hierarchical reinforcement learning as a promising framework for ...
Shoubhanik Nath, Shauryaraj K. Jilkar, Aditya Udgaonkar, Yu (Joe) Lu, Ali Mesbah   +4 more
wiley   +1 more source

An interpretable Convex Stacking with Guarded Calibration ensemble approach for predicting rock fragmentation in mine blasting. [PDF]

Sci Rep
Lin C, Sun X, Mai J, Liu B, Cheng P.
europepmc   +1 more source

<i>"Solid Hollows"</i> and "<i>Reverspectives"</i>: Similarities and differences. [PDF]

Iperception
Rogers B, Hughes P.
europepmc   +1 more source

Three New Species, New Records, and a Key to <i>Dryops</i> Olivier, 1791 (Coleoptera: Dryopidae) from Brazil. [PDF]

Insects
Alexandre MSL, Clarkson B, Fernandes AS, Moreira FFF.   +3 more
europepmc   +1 more source

A polyphasic study of Hypoxylaceae (Xylariales, Ascomycota) in Iran: new species and records from Hyrcanian forests. [PDF]

MycoKeys
Pourmoghaddam MJ, Lambert C, Voglmayr H, Khodaparast SA, Stadler M.   +4 more
europepmc   +1 more source

Convex Hartree-Fock theory for modeling ground state conical intersections. [PDF]

Commun Chem
Rossi F, Koch H.
europepmc   +1 more source