Methodological Frameworks for Computational Electrocatalysis: From Theory to Practice
Computational modeling is widely used to investigate electrocatalytic reactions, yet accurately describing electrochemical interfaces remains challenging. This review outlines theoretical and computational strategies, based on density functional theory, to model reaction thermodynamics, solvation effects, applied bias, and kinetics.
Michele Re Fiorentin +8 more
wiley +1 more source
Proper Orthogonal Decomposition and Spectral Analysis of a Wall-Mounted Square Cylinder Wake
The flow patterns over a finite square cylinder of aspect ratio of 3 were analyzed experimentally in a subsonic wind tunnel using the time-resolved particle image velocimetry (TR - PIV) techniques.
Henrique Fanini Leite +4 more
doaj
Two‐dimensional transition metal boride‐based materials as electrocatalysts for nitrate reduction reaction (NO3RR). It covers the synthesis and structure of Mbenes for electrocatalytic nitrate reduction reaction (NO3RR) to ammonia, including ammonia detection methods, following the future perspectives.
Naseem Ahmad Khan +7 more
wiley +1 more source
Structure identification in pipe flow using proper orthogonal decomposition. [PDF]
Hellström LH, Smits AJ.
europepmc +1 more source
Bayesian Adaptive Polynomial Chaos Expansions
ABSTRACT Polynomial chaos expansions (PCEs) are widely used for uncertainty quantification (UQ) tasks, particularly in the applied mathematics community. However, PCE has received comparatively less attention in the statistics literature, and fully Bayesian formulations remain rare—especially with implementations in R.
Kellin N. Rumsey +4 more
wiley +1 more source
Use of proper orthogonal decomposition and machine learning for efficient blood flow prediction in cerebral saccular aneurysms. [PDF]
Rajhi W +7 more
europepmc +1 more source
Merging computational fluid dynamics and 4D Flow MRI using proper orthogonal decomposition and ridge regression. [PDF]
Bakhshinejad A +5 more
europepmc +1 more source
Abstract In this paper, Singular Spectral Analysis (SSA) is applied to the geomagnetic field to delineate signatures from different sources, such as geomagnetic variability and lithospheric processes. We performed SSA on the Y component of the Swarm satellite magnetic field By during the period from September 2023 to January 2024. Eigen values obtained
Amrita Yadav +4 more
wiley +1 more source
Temporal Extrapolation Generalization of Proper Orthogonal Decomposition (POD) and Radial Basis Function (RBF) Surrogates for Transient Thermal Fields in Multi-Heat-Source Electronic Devices. [PDF]
Zhao W, Zhang B.
europepmc +1 more source

