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
Federated spatio-temporal graph neural network for privacy-preserving vehicle trajectory prediction in autonomous driving. [PDF]
Joshi A +4 more
europepmc +1 more source
Mesenchymal stromal cells (MSCs) show promise for treating immune‐related disorders through immunomodulation and tissue regeneration. This review gives a brief overview of current clinical approval of MSC therapies. It also discussed how bioengineering, including genetic modification, biomaterial delivery, extracellular vesicles, and iPSC‐derived MSCs,
Sichen Yang +6 more
wiley +1 more source
ANN-PSO Hybrid ML-Optimization of a Hollow-Disk Resonator-Based Photonic Crystal Optical Sensor for HeLa Cell Tumor Detection. [PDF]
Bouaouina MS +3 more
europepmc +1 more source
Springback Behavior and Stroke-Based Compensation Strategy for Roll-Based Bending of High-Strength Aluminum Extrusions. [PDF]
Lim J +5 more
europepmc +1 more source
Hybrid deep learning and ES-MDA for pressure transient inversion in radial composite reservoirs. [PDF]
Abdollahfard Y +3 more
europepmc +1 more source
PARSEC.py: A Python-Based Real-Space Kohn-Sham Density Functional Theory Code Accelerated by Machine Learned Charge Density. [PDF]
Zhang Z +4 more
europepmc +1 more source
Convergence of the Immersed Interface Method in Linear Elasticity. [PDF]
Asghar S +3 more
europepmc +1 more source
Anisotropy-driven reshaping and diagnostic limits of high-charge perfect optical vortices. [PDF]
Pandey Y, Kumar R, Bisht NS.
europepmc +1 more source

