Results 171 to 180 of about 171,040 (210)

Limitations of Foundation Models in Energy Materials Simulations: A Case Study in Polyanion Sodium Cathode Materials

Advanced Intelligent Discovery, EarlyView.
Several simulation techniques are used to explore static and dynamic behavior in polyanion sodium cathode materials. The study reveals that universal machine learning interatomic potentials (MLIPs) struggle with system‐specific chemistry, emphasizing the need for tailored datasets.
Martin Hoffmann Petersen, Chiku Parida, Jonas Busk, Jin Hyun Chang, Arghya Bhowmik, Juan Maria Garcia Lastra   +5 more
wiley   +1 more source

Machine Learning Prediction of Road Performance of Cold Recycled Mix Asphalt with Genetic Algorithm Hyperparameter Optimization. [PDF]

Materials (Basel)
Wu Z, Li S, Wang D, Qiu M, Fang C, Yang J, Tang H.   +6 more
europepmc   +1 more source

Inverse Design of Alloys via Generative Algorithms: Optimization and Diffusion within Learned Latent Space

Advanced Intelligent Discovery, EarlyView.
This work presents a novel generative artificial intelligence (AI) framework for inverse alloy design through operations (optimization and diffusion) within learned compact latent space from variational autoencoder (VAE). The proposed work addresses challenges of limited data, nonuniqueness solutions, and high‐dimensional spaces.
Mohammad Abu‐Mualla, Ellis Crabtree, Fredrick Michael, Yayue Pan, Jida Huang   +4 more
wiley   +1 more source

Combining K-fold cross validation with bayesian hyperparameter optimization for accuracy enhancement of land cover and land use classification. [PDF]

Sci Rep
Heidari P, Milan A.
europepmc   +1 more source

Deep Learning‐Assisted Coherent Raman Scattering Microscopy

Advanced Intelligent Discovery, EarlyView.
The analytical capabilities of coherent Raman scattering microscopy are augmented through deep learning integration. This synergistic paradigm improves fundamental performance via denoising, deconvolution, and hyperspectral unmixing. Concurrently, it enhances downstream image analysis including subcellular localization, virtual staining, and clinical ...
Jianlin Liu, Rujia Liu, Xinyan Zhang, Xun Chen, Shuhua Yue   +4 more
wiley   +1 more source

Reward design and hyperparameter tuning for generalizable deep reinforcement learning agents in autonomous racing. [PDF]

Sci Rep
Kunda NSS, Kc P, Pandey M, Kumaar AAN.
europepmc   +1 more source

A Machine Learning Model for Interpretable PECVD Deposition Rate Prediction

Advanced Intelligent Discovery, EarlyView.
This study develops six machine learning models (k‐nearest neighbors, support vector regression, decision tree, random forest, CatBoost, and backpropagation neural network) to predict SiNx deposition rates in plasma‐enhanced chemical vapor deposition using hybrid production and simulation data.
Yuxuan Zhai, Wenrui Wang, Rui Chen, Tong Yu, Xiaojuan Zheng, Hua Shao, Dashan Shang, Ling Li, Lado Filipovic   +8 more
wiley   +1 more source

Adaptive deep clustering integrating DINOv2 embeddings, graph attention, and bio-inspired optimization. [PDF]

Sci Rep
Abdrabo M, Refaat H, Abdallah M, Farouk O.   +3 more
europepmc   +1 more source

Interpretable Machine Learning for Solvent‐Dependent Carrier Mobility in Solution‐Processed Organic Thin Films

Advanced Intelligent Discovery, EarlyView.
This work establishes a correlation between solvent properties and the charge transport performance of solution‐processed organic thin films through interpretable machine learning. Strong dispersion interactions (δD), moderate hydrogen bonding (δH), closely matching and compatible with the solute (quadruple thiophene), and a small molar volume (MolVol)
Tianhao Tan, Lian Duan, Dong Wang
wiley   +1 more source