38 citations · 48 across the 3 of their papers we have counts for
4 papers
Understanding the chemical shifts of aqueous electrolyte species adsorbed in carbon nanopores
Anagha Sasikumar, John M. Griffin, Céline Merlet
Interfaces between aqueous electrolytes and nanoporous carbons are involved in a number of technological applications such as energy storage and capacitive deionization. The disord…
Mesoscopic simulations of the in situ NMR spectra of porous carbon based supercapacitors: Electronic structure and adsorbent reorganisation effects
Anagha Sasikumar, Anouar Belhboub, Camille Bacon +5
In situ NMR spectroscopy is a powerful technique to investigate charge storage mechanisms in carbon-based supercapacitors thanks to its ability to distinguish ionic and molecular s…
NMR studies of adsorption and diffusion in porous carbonaceous materials
Alexander C. Forse, Céline Merlet, Clare P. Grey +1
Porous carbonaceous materials have many important industrial applications including energy storage, water purification, and adsorption of volatile organic compounds. Most of their…
Lattice simulation method to model diffusion and NMR spectra in porous materials
Céline Merlet, Alexander C. Forse, John M. Griffin +2
A coarse-grained simulation method to predict NMR spectra of ions diffusing in porous carbons is proposed. The coarse-grained model uses input from molecular dynamics simulations s…