Exfoliated Metal Oxide Nanosheets as Effective and Applicable Substrates for Atomically Dispersed Metal Nanoparticles with Tailorable Functionalities

A Seamless Grid-based Interface for Mean-field QM/MM Coupled with Efficient Solvation Free Energy Calculations

Solubility Prediction of Organic Ionic Compounds with Computational Methods for Photoresist Application

Failure of Density Functional Dispersion Correction in Metallic Systems and Its Possible Solution Using a Modified Many-Body Dispersion Correction

Intracavity Conformational Changes in Clathrate Hydrates

Probing Distinct Fullerene Formation Processes from Carbon Precursors of Different Sizes and Structures

Highly Efficient, Selective, and Stable CO2 Electroreduction on a Hexagonal Zn Catalyst

A Conductive Hybridization Matrix of RuO2 Two-Dimensional Nanosheets: A Hybrid-Type Photocatalyst

First-principles Investigation of Two-dimensional Trichalcogenide and Sesquichalcogenide Monolayers

Control of the Mechanical Strength of a Bipyridine-based Polymeric Gel from Linear Nanofibre to Helix with a Chiral Dopant