Origamic metal-organic framework toward mechanical metamaterial

Symmetry-Mismatched SBU Transformation in MOFs: Postsynthetic Metal Exchange from Zn to Fe and Its Effects on Gas Adsorption and Dye Selectivity

Real-Space and Real-Time Propagation for Correlated Electron-Nuclear Dynamics Based on Exact Factorization

Calculation of exciton couplings based on density functional tight-binding coupled to state-interaction state-averaged ensemble-referenced Kohn-Sham approach

Silver sulfide nanocrystals as a biocompatible and full-spectrum photocatalyst for efficient light-driven polymerization under aqueous and ambient conditions

Atomic transistors based on seamless lateral metal-semiconductor junctions with a sub-1-nm transfer length

Generalized Formulation of the Density Functional Tight Binding-Based Restricted Ensemble Kohn-Sham Method with Onsite Correction to Long-Range Correction

Independent trajectory mixed quantum-classical approaches based on the exact factorization

Singlet Oxygen Generation from Polyaminoglycerol by Spin-Flip-Based Electron Transfer

Coupled- and Independent-Trajectory Approaches Based on the Exact Factorization Using the PyUNIxMD Package