Cargando…

Use of the PIXEL method to investigate gas adsorption in metal–organic frameworks

PIXEL has been used to perform calculations of adsorbate-adsorbent interaction energies between a range of metal–organic frameworks (MOFs) and simple guest molecules. Interactions have been calculated for adsorption between MOF-5 and Ar, H(2), and N(2); Zn(2)(BDC)(2)(TED) (BDC = 1,4-benzenedicarboxy...

Descripción completa

Detalles Bibliográficos
Autores principales:	Maloney, Andrew G. P., Wood, Peter A., Parsons, Simon
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Royal Society of Chemistry 2016
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5361143/ https://www.ncbi.nlm.nih.gov/pubmed/28496380 http://dx.doi.org/10.1039/c6ce00555a

Ejemplares similares

Recent advances in metal–organic frameworks for gas adsorption/separation
por: Jiang, Chuanhai, et al.
Publicado: (2022)

Predicting adsorption selectivities from pure gas isotherms for gas mixtures in metal–organic frameworks
por: Kundu, Arpan, et al.
Publicado: (2019)

Adsorption of iodine in metal–organic framework materials
por: Zhang, Xinran, et al.
Publicado: (2022)

Metal-organic frameworks for food contaminant adsorption and detection
por: Guo, Xueqi, et al.
Publicado: (2023)

Experimental investigation of the dehumidification and decarburization performance of metal–organic frameworks in solid adsorption air conditioning
por: Chen, Liu, et al.
Publicado: (2023)

Recent Advances in the Use of Metal-Organic Frameworks for Dye Adsorption
por: Au, Vonika Ka-Man
Publicado: (2020)

Modelling drug adsorption in metal–organic frameworks: the role of solvent
por: Sose, Abhishek T., et al.
Publicado: (2021)

Charged porous organic frameworks bearing heteroatoms with enhanced isosteric enthalpies of gas adsorption
por: Xing, Guolong, et al.
Publicado: (2018)

Cationic nickel metal-organic frameworks for adsorption of negatively charged dye molecules
por: Ezugwu, Chizoba I., et al.
Publicado: (2018)

Synthesis and adsorption performance of La@ZIF-8 composite metal–organic frameworks
por: Li, Junqi, et al.
Publicado: (2020)

Biomimetic O(2) adsorption in an iron metal–organic framework for air separation
por: Reed, Douglas A., et al.
Publicado: (2020)

Influence of carbohydrate polymer shaping on organic dye adsorption by a metal–organic framework in water
por: Tanimoto, Yutaro, et al.
Publicado: (2021)

Effect of metal–ligand ratio on the CO(2) adsorption properties of Cu–BTC metal–organic frameworks
por: Liu, Yuanyuan, et al.
Publicado: (2018)

Synthesis and Characterization of 2D Metal-Organic Frameworks for Adsorption of Carbon Dioxide and Hydrogen
por: Tshuma, Piwai, et al.
Publicado: (2020)

Synthesis, characterization, and CO(2) adsorption properties of metal organic framework Fe-BDC
por: Mahdipoor, Hamid Reza, et al.
Publicado: (2021)

Charting the Complete Thermodynamic Landscape of Gas Adsorption for a Responsive Metal–Organic Framework
por: Goeminne, Ruben, et al.
Publicado: (2021)

Graphene inclusion controlling conductivity and gas sorption of metal–organic framework
por: Lamagni, Paolo, et al.
Publicado: (2018)

Metal–organic frameworks for advanced transducer based gas sensors: review and perspectives
por: Majhi, Sanjit Manohar, et al.
Publicado: (2021)

A window-space-directed assembly strategy for the construction of supertetrahedron-based zeolitic mesoporous metal–organic frameworks with ultramicroporous apertures for selective gas adsorption
por: Zhang, Lei, et al.
Publicado: (2021)

Facile synthesis of magnesium-based metal-organic framework with tailored nanostructure for effective volatile organic compounds adsorption
por: Hu, Zichu, et al.
Publicado: (2022)

Screening of metal–organic frameworks for water adsorption heat transformation using structure–property relationships
por: Xu, Min, et al.
Publicado: (2020)

A Review on Breathing Behaviors of Metal-Organic-Frameworks (MOFs) for Gas Adsorption
por: Alhamami, Mays, et al.
Publicado: (2014)

Role of molecular modelling in the development of metal-organic framework for gas adsorption applications
por: Jose, Reshma, et al.
Publicado: (2023)

Direct structural evidence of commensurate-to-incommensurate transition of hydrocarbon adsorption in a microporous metal organic framework
por: Banerjee, Debasis, et al.
Publicado: (2016)

Hydrogen adsorption mechanism of MOF-74 metal–organic frameworks: an insight from first principles calculations
por: Nguyen-Thuy, Trang, et al.
Publicado: (2020)

A multifunctional microporous metal–organic framework: efficient adsorption of iodine and column-chromatographic dye separation
por: Yao, Chan, et al.
Publicado: (2018)

Cooperative CO(2) adsorption mechanism in a perfluorinated Ce(IV)-based metal organic framework
por: Cavallo, Margherita, et al.
Publicado: (2023)

Selective Adsorption-Based Separation of Flue Gas and Natural Gas in Zirconium Metal-Organic Frameworks Nanocrystals
por: Li, Pengli, et al.
Publicado: (2019)

Boosting CO(2) adsorption and selectivity in metal–organic frameworks of MIL-96(Al) via second metal Ca coordination
por: Abid, Hussein Rasool, et al.
Publicado: (2020)

Structural characterization of framework–gas interactions in the metal–organic framework Co(2)(dobdc) by in situ single-crystal X-ray diffraction
por: Gonzalez, Miguel I., et al.
Publicado: (2017)

Gas Adsorption Equilibria: Experimental Methods and Adsorption Isotherms
por: Keller, Jürgen, et al.
Publicado: (2005)

A significant change in selective adsorption behaviour for ethanol by flexibility control through the type of central metals in a metal–organic framework
por: Sadakiyo, Masaaki, et al.
Publicado: (2016)

A regenerative metal–organic framework for reversible uptake of Cd(ii): from effective adsorption to in situ detection
por: Xue, Hui, et al.
Publicado: (2016)

Adsorption characteristics of metal–organic framework MIL-101(Cr) towards sulfamethoxazole and its persulfate oxidation regeneration
por: Huang, Xiaoli, et al.
Publicado: (2018)

High capacity ammonia adsorption in a robust metal–organic framework mediated by reversible host–guest interactions
por: Guo, Lixia, et al.
Publicado: (2022)

Simultaneous adsorption of SO(2) and CO(2) in an Ni(bdc)(ted)(0.5) metal–organic framework
por: Son, Do Ngoc, et al.
Publicado: (2018)

Adsorptive, kinetics and regeneration studies of fluoride removal from water using zirconium-based metal organic frameworks
por: Tan, Tong Ling, et al.
Publicado: (2020)

Kinetics of cooperative CO(2) adsorption in diamine-appended variants of the metal–organic framework Mg(2)(dobpdc)
por: Martell, Jeffrey D., et al.
Publicado: (2020)

Removal of diclofenac by adsorption process studied in free-base porphyrin Zr-metal organic frameworks (Zr-MOFs)
por: Prasetya, Nicholaus, et al.
Publicado: (2023)

Computational evaluation of metal pentazolate frameworks: inorganic analogues of azolate metal–organic frameworks
por: Arhangelskis, Mihails, et al.
Publicado: (2018)

Cannot write session to /tmp/vufind_sessions/sess_4rmrs37mu8ops8b0mf2uck6kt1