Recent Advances and Perspectives for Intercalation Layered Compounds Part 1: Design and applications in the field of energy

C Bisio, J Brendlé, S Cahen, Y Feng, SJ Hwang… - Dalton …, 2024 - pubs.rsc.org
Herein, initially, we present a general overview of the global financial support for chemistry
devoted to materials science, specifically intercalation layered compounds (ILCs) …

Diffusion of ferrocene through vanadyl phosphate by density functional theory

Y Liu, AT Ta, RS Ullberg, J Liu, DR Talham… - Physical Chemistry …, 2024 - pubs.rsc.org
Here, we employed the nudged elastic band (NEB) method to simulate the diffusion of
ferrocene through vanadyl phosphate (VOPO4), with a focus on understanding the diffusion …