activity
20202022
most citedEC-MOF/Phase-I: A computationally ready database of electrically conductive metal-organic frameworks with high-throughput structural and electronic properties

35 citations · 47 across the 3 of their papers we have counts for

collaborators
Showing 2020Show all

1 paper · 1 filter

cond-mat.mtrl-sci2020

Unravelling Water Stability and Electrical Conductivity of 2D Layered Metal-Organic Frameworks in Aqueous Solutions

Mohammad R. Momeni, Zeyu Zhang, David Dell'Angelo +1

Molecular dynamics simulations combined with periodic electronic structure calculations are performed to decipher structural, thermodynamical and dynamical properties of the interf…