Exploring the Structural, Dynamic, and Functional Properties of Metal‐Organic Frameworks through Molecular Modeling
This review spotlights the role of atomic‐level modeling in research on metal‐organic
frameworks (MOFs), especially the key methodologies of density functional theory (DFT) …
frameworks (MOFs), especially the key methodologies of density functional theory (DFT) …
A review on zeolite imidazole frameworks: synthesis, properties, and applications
Zeolitic imidazolate frameworks (ZIFs) consist of transition metal ions (Zinc or Cobalt) and
imidazolate (Im) linkers in tetrahedral coordination surrounded by nitrogen atoms from the …
imidazolate (Im) linkers in tetrahedral coordination surrounded by nitrogen atoms from the …
[HTML][HTML] MOF membranes for CO2 capture: past, present and future
As the society is projected to continue relying on fossil fuels for energy needs in the next
decades, the increasing level of CO 2 emissions due to fossil fuel use can pose bigger …
decades, the increasing level of CO 2 emissions due to fossil fuel use can pose bigger …
Recent advances in the application of zeolitic imidazolate frameworks (ZIFs) in environmental remediation: a review
Y Sun, N Zhang, Y Yue, J Xiao, X Huang… - Environmental Science …, 2022 - pubs.rsc.org
As one of porous metal–organic frameworks, zeolitic imidazolate frameworks (ZIFs) are
typical crystalline materials with tetrahedral clusters such as ZnN4 and CoN4 linked by …
typical crystalline materials with tetrahedral clusters such as ZnN4 and CoN4 linked by …
Tuning the phase composition of metal–organic framework membranes for helium separation through incorporation of fullerenes
J Han, H Wu, H Fan, L Ding, G Hai… - Journal of the …, 2023 - ACS Publications
Metal–organic framework (MOF) membranes have attracted significant research interest in
gas separation, but efficient helium (He) separation remains a challenge due to the weak …
gas separation, but efficient helium (He) separation remains a challenge due to the weak …
Unlocking the potential of ZIF-based electrocatalysts for electrochemical reduction of CO2: Recent advances, current trends, and machine learnings
The socio-economic advancements have led to the emergence of anthropogenic carbon
dioxide (CO 2) emissions, which have had a profound influence on ecosystems and climate …
dioxide (CO 2) emissions, which have had a profound influence on ecosystems and climate …
Recent advances in simulating gas permeation through MOF membranes
In the last two decades, metal organic frameworks (MOFs) have gained increasing attention
in membrane-based gas separations due to their tunable structural properties …
in membrane-based gas separations due to their tunable structural properties …
Data mining for predicting gas diffusivity in zeolitic-imidazolate frameworks (ZIFs)
Molecular sieving is based on mobility differences of species under extreme confinement, ie
within pores of molecular dimensions. The pore properties of a material determine its …
within pores of molecular dimensions. The pore properties of a material determine its …
Fabrication of ZnO/Pd@ ZIF-8/Pt hybrid for selective methane detection in the presence of ethanol and NO2
The exploration of novel sensing materials for selective identification of methane (CH 4) is
critical for practical applications, particularly in the presence of ethanol (C 2 H 5 OH) and …
critical for practical applications, particularly in the presence of ethanol (C 2 H 5 OH) and …
Modifying CsPbX3 (X = Cl, Br, I) with a Zeolitic Imidazolate Framework through Mechanical Milling for Aqueous Photocatalytic H2 Evolution
S Feng, S Ning, L Wang, J Zhao, J Ou… - ACS Applied Energy …, 2022 - ACS Publications
All-inorganic perovskite nanocrystals (CsPbX3, X= Cl, Br, and I) have attracted increasing
attention in various fields due to their unique optoelectronic properties. However, the …
attention in various fields due to their unique optoelectronic properties. However, the …