The Importance of Metal‐Organic Framework Linker Atoms for CO2 Reduction: A DFT Study
Using DFT, we examine the role of linker atoms in CO2 reduction on copper‐based metal organic frameworks (Cu MOFs). Our calculations reveal that linker atoms may serve as both CO2 and H‐shuttling sites and suggest linker electrostatics as a descriptor for linker activity. ABSTRACT Although the metal within the secondary building unit of a metal‐organic
Ugochukwu Nwosu, Samira Siahrostami
wiley +1 more source
Delay-Induced Complexity and Chaotic Dynamics in a Network Model of Information Spreading. [PDF]
Martsenyuk V, Gancarczyk T.
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Physics‐Embedded Neural Network: A Novel Approach to Design Polymeric Materials
Traditional black‐box models for polymer mechanics rely solely on data and lack physical interpretability. This work presents a physics‐embedded neural network (PENN) that integrates constitutive equations into machine learning. The approach ensures reliable stress predictions, provides interpretable parameters, and enables performance‐driven, inverse ...
Siqi Zhan +8 more
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Real-time HIL validation of a lyapunov-guaranteed optimal FOPID controller for quadrotor UAV trajectory tracking. [PDF]
Elbasueny B +4 more
europepmc +1 more source
Based on Nonlinear Control Theory: Quantum System Regulation
This paper investigates the application of nonlinear control theory to the precise regulation of quantum systems. Traditional control methods often struggle with the inherent complexities and sensitivities of quantum systems. This work proposes a novel approach leveraging nonlinear control techniques to directly manipulate quantum state evolution.
openaire +1 more source
ML Workflows for Screening Degradation‐Relevant Properties of Forever Chemicals
The environmental persistence of per‐ and polyfluoroalkyl substances (PFAS) necessitates efficient remediation strategies. This study presents physics‐informed machine learning workflows that accurately predict critical degradation properties, including bond dissociation energies and polarizability.
Pranoy Ray +3 more
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Energy localization and spatiotemporal pattern evolution mechanism of spatial thin-film structures under parametric excitation. [PDF]
Li T, Tong X, Liu X, Zhou D.
europepmc +1 more source
In this research article, Mansoor and coworkers present a novel device that applies controlled mechanical stimuli to cardiomyocytes using pressure‐driven membrane deformation. By exposing cells to physiologically and pathologically relevant loading conditions, the platform reproduces distinct structural, functional and molecular responses associated ...
Haris Mansoor +11 more
wiley +1 more source
Dynamical analysis and exact solitary wave solutions of [Formula: see text]-dimensional integro-differential Jaulent-Miodek equation using two analytical schemes. [PDF]
Nasir B +5 more
europepmc +1 more source

