Structure, Properties, and Applications of Silica Nanoparticles: Recent Theoretical Modeling Advances, Challenges, and Future Directions
Silica nanoparticles (SNPs), one of the most widely researched materials in modern science,
are now commonly exploited in surface coatings, biomedicine, catalysis, and engineering of …
are now commonly exploited in surface coatings, biomedicine, catalysis, and engineering of …
Wetting preference of silica surfaces in the context of underground hydrogen storage: A molecular dynamics perspective
The growing interest in large-scale underground hydrogen (H2) storage (UHS) emphasizes
the need for a comprehensive understanding of the fundamental characteristics of …
the need for a comprehensive understanding of the fundamental characteristics of …
Hydrogen bonding to the electron accepting group controls the absorption spectrum of a push–pull stilbene adsorbed on amorphous silica
The photophysical and photochemical properties of push–pull photoswitches, such as
stilbene derivatives, are very sensitive to their surroundings, allowing, eg, for the control of …
stilbene derivatives, are very sensitive to their surroundings, allowing, eg, for the control of …
Accurate Force Field for Carbon Dioxide–Silica Interactions Based on Density Functional Theory
Fluid–silica interfaces are ubiquitous in chemistry, occurring in both natural geochemical
environments and practical applications ranging from separations to catalysis. Simulations …
environments and practical applications ranging from separations to catalysis. Simulations …