Molecular Design Strategies for High‐Voltage Organic Cathodes
This work proposes molecular engineering strategies for high‐voltage organic cathode materials for Li‐ion batteries: (1) increase Li‐O coordination number (CN), (2) achieve a greater increase in aromaticity upon reduction (∆Aromaticity), and (3) add an electron‐withdrawing group (EWG), through a combined experimental and computational study on reported
Sungil Hong +8 more
wiley +1 more source
Disorder‐Driven Ionic Mobility Edge and Localization‐Driven Dendrite Formation in Solid Electrolytes
Migration‐barrier disorder localizes ionic transport into a sparse percolation backbone. Current and electric‐field focusing at filament tips promote fractal dendrite growth and suppress the critical current density according to jcrit = j0 exp(−σEeff/kBT).
Dongwook Lee, Jiwon Seo
wiley +1 more source
A general framework for extrapolation-aware prediction reliability in forward and inverse analyses of Gaussian mixture regression models. [PDF]
Kaneko H.
europepmc +1 more source
Food Prices and Inflation Expectations in New Zealand
ABSTRACT Food prices are conspicuous, and spending on food constitutes a considerable share of household expenditure. In this study, we use partially identified Bayesian structural vector autoregression models to analyze the effects of food price shocks on core inflation and 1‐ and 5‐year inflation expectations in New Zealand.
Puneet Vatsa +2 more
wiley +1 more source
Learning variable-order time fractional diffusion equations using Physics-Informed Neural Networks. [PDF]
Ren L, Jin S.
europepmc +1 more source
ABSTRACT Hybrid modeling combines first‐principles equations with a data‐driven subcomponent. Training for the data‐driven part is sensitive to measurement noise when training targets are constructed using pointwise time derivatives. Beyond differentiation errors, hybrid models involve solving an inverse problem to estimate the data‐driven term, which ...
Hangjun Cho +4 more
wiley +1 more source
Gradient Systems and Asymmetric Relaxations in View of Riemannian Geometry. [PDF]
Bravetti A +2 more
europepmc +1 more source
A novel convolutional neural network architecture enables rapid, unsupervised analysis of IR spectroscopic data from DRIFTS and IRRAS. By combining synthetic data generation with parallel convolutional layers and advanced regularization, the model accurately resolves spectral features of adsorbed CO, offering real‐time insights into ceria surface ...
Mehrdad Jalali +5 more
wiley +1 more source
On learning functions over biological sequence space: relating Gaussian process priors, regularization, and gauge fixing. [PDF]
Petti S +4 more
europepmc +1 more source
THE NORMAL INVERSE GAUSSIAN DISTRIBUTION AND SPOT PRICE MODELLING IN ENERGY MARKETS
F. Benth, J. Saltyte-Benth
semanticscholar +1 more source

