Electronic structure modeling of metal–organic frameworks
Owing to their molecular building blocks, yet highly crystalline nature, metal–organic
frameworks (MOFs) sit at the interface between molecule and material. Their diverse …
frameworks (MOFs) sit at the interface between molecule and material. Their diverse …
Chemical, thermal and mechanical stabilities of metal–organic frameworks
The construction of thousands of well-defined, porous, metal–organic framework (MOF)
structures, spanning a broad range of topologies and an even broader range of pore sizes …
structures, spanning a broad range of topologies and an even broader range of pore sizes …
Air-stable Cu (I) metal–organic framework for hydrogen storage
Metal–organic frameworks (MOFs) that contain open metal sites have the potential for
storing hydrogen (H2) at ambient temperatures. In particular, Cu (I)-based MOFs …
storing hydrogen (H2) at ambient temperatures. In particular, Cu (I)-based MOFs …
ELATE: an open-source online application for analysis and visualization of elastic tensors
R Gaillac, P Pullumbi, FX Coudert - Journal of Physics …, 2016 - iopscience.iop.org
We report on the implementation of a tool for the analysis of second-order elastic stiffness
tensors, provided with both an open-source Python module and a standalone online …
tensors, provided with both an open-source Python module and a standalone online …
Topologically guided tuning of Zr-MOF pore structures for highly selective separation of C6 alkane isomers
As an alternative technology to energy intensive distillations, adsorptive separation by
porous solids offers lower energy cost and higher efficiency. Herein we report a topology …
porous solids offers lower energy cost and higher efficiency. Herein we report a topology …
Flexible metal–organic frameworks: recent advances and potential applications
Z Chang, DH Yang, J Xu, TL Hu, XH Bu - Advanced Materials, 2015 - Wiley Online Library
Flexible metal–organic frameworks (MOFs) receive much attention owing to their attractive
properties that originate from their flexibility and dynamic behavior, and show great potential …
properties that originate from their flexibility and dynamic behavior, and show great potential …
Correlated defect nanoregions in a metal–organic framework
Throughout much of condensed matter science, correlated disorder is a key to material
function. While structural and compositional defects are known to exist within a variety of …
function. While structural and compositional defects are known to exist within a variety of …
Responsive metal–organic frameworks and framework materials: under pressure, taking the heat, in the spotlight, with friends
FX Coudert - Chemistry of Materials, 2015 - ACS Publications
Recent years have seen a large increase of the research effort focused on framework
materials, including the nowadays-ubiquitous metal–organic frameworks but also dense …
materials, including the nowadays-ubiquitous metal–organic frameworks but also dense …
Mechanical properties of metal–organic frameworks
LR Redfern, OK Farha - Chemical science, 2019 - pubs.rsc.org
As the field of metal–organic frameworks (MOFs) continues to grow, the physical stability
and mechanical properties of these porous materials has become a topic of great interest …
and mechanical properties of these porous materials has become a topic of great interest …
Elucidation of flexible metal-organic frameworks: Research progresses and recent developments
Flexibility is a unique property of metal-organic frameworks (MOFs) that differentiates them
from other rigid inorganic porous materials such as zeolites and porous silica. Flexible …
from other rigid inorganic porous materials such as zeolites and porous silica. Flexible …