The chemistry and applications of hafnium and cerium (IV) metal–organic frameworks
The coordination connection of organic linkers to the metal clusters leads to the formation of
metal–organic frameworks (MOFs), where the metal clusters and ligands are spatially …
metal–organic frameworks (MOFs), where the metal clusters and ligands are spatially …
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 …
[HTML][HTML] Understanding the diversity of the metal-organic framework ecosystem
Millions of distinct metal-organic frameworks (MOFs) can be made by combining metal
nodes and organic linkers. At present, over 90,000 MOFs have been synthesized and over …
nodes and organic linkers. At present, over 90,000 MOFs have been synthesized and over …
An artificial sodium-selective subnanochannel
Single-ion selectivity with high precision has long been pursued for fundamental bioinspired
engineering and applications such as in ion separation and energy conversion. However, it …
engineering and applications such as in ion separation and energy conversion. However, it …
Performance-based screening of porous materials for carbon capture
Computational screening methods have changed the way new materials and processes are
discovered and designed. For adsorption-based gas separations and carbon capture, recent …
discovered and designed. For adsorption-based gas separations and carbon capture, recent …
[PDF][PDF] An all-round AI-Chemist with a scientific mind
Q Zhu, F Zhang, Y Huang, H **ao… - National Science …, 2022 - academic.oup.com
The realization of automated chemical experiments by robots unveiled the prelude to an
artificial intelligence (AI) laboratory. Several AI-based systems or robots with specific …
artificial intelligence (AI) laboratory. Several AI-based systems or robots with specific …
Construction of angstrom-scale ion channels with versatile pore configurations and sizes by metal-organic frameworks
Controllable fabrication of angstrom-size channels has been long desired to mimic
biological ion channels for the fundamental study of ion transport. Here we report a strategy …
biological ion channels for the fundamental study of ion transport. Here we report a strategy …
A data-science approach to predict the heat capacity of nanoporous materials
The heat capacity of a material is a fundamental property of great practical importance. For
example, in a carbon capture process, the heat required to regenerate a solid sorbent is …
example, in a carbon capture process, the heat required to regenerate a solid sorbent is …
[HTML][HTML] Recent advances, opportunities, and challenges in high-throughput computational screening of MOFs for gas separations
In the last two decades, metal organic frameworks (MOFs) have gained significant attention
as adsorbent and membrane materials for gas separations. Due to the large number and …
as adsorbent and membrane materials for gas separations. Due to the large number and …
The chemistry of reticular framework nanoparticles: MOF, ZIF, and COF materials
Nanoparticles have become a vital part of a vast number of established processes and
products; they are used as catalysts, in cosmetics, and even by the pharmaceutical industry …
products; they are used as catalysts, in cosmetics, and even by the pharmaceutical industry …