Molecular simulations of adsorption and separation of ethylene/ethane and propylene/propane mixtures on Ni2(dobdc) and Ni2(m-dobdc) metal-organic frameworks

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(2018)   CHEMPHYSCHEM

Effects of Open Metal Site Availability on Adsorption Capacity and Olefin/Paraffin Selectivity in the Metal–Organic Framework Cu3(BTC)2

(2016) Jason Bentley et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

CO2 Adsorption in Fe2(dobdc): A Classical Force Field Parameterized from Quantum Mechanical Calculations

(2014) Joshua Borycz et al.   Journal of Physical Chemistry C

Adsorption and Diffusion of Light Hydrocarbons in UiO-66(Zr): A Combination of Experimental and Modeling Tools

(2014) N. A. Ramsahye et al.   Journal of Physical Chemistry C

M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal–Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites

(2014) Matthew T. Kapelewski et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Computational approaches to study adsorption in MOFs with unsaturated metal sites

(2014) Michael Fischer et al.   MOLECULAR SIMULATION

Molecular simulations in metal–organic frameworks for diverse potential applications

(2014) Jianwen Jiang   MOLECULAR SIMULATION

Hydrocarbon Separations in Metal–Organic Frameworks

(2013) Zoey R. Herm et al.   CHEMISTRY OF MATERIALS

Adsorption on Fe-MOF-74 for C1–C3 Hydrocarbon Separation

(2013) Pragya Verma et al.   Journal of Physical Chemistry C

Design of a Metal–Organic Framework with Enhanced Back Bonding for Separation of N2 and CH4

(2013) Kyuho Lee et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Selective adsorption of ethylene over ethane and propylene over propane in the metal–organic frameworks M2(dobdc) (M = Mg, Mn, Fe, Co, Ni, Zn)

(2013) Stephen J. Geier et al.   Chemical Science

Modeling Adsorption in Metal–Organic Frameworks with Open Metal Sites: Propane/Propylene Separations

(2012) Michael Fischer et al.   LANGMUIR

Hydrocarbon Separations in a Metal-Organic Framework with Open Iron(II) Coordination Sites

(2012) E. D. Bloch et al.   SCIENCE

Porous metal–organic frameworks as platforms for functional applications

(2011) Hai-Long Jiang et al.   CHEMICAL COMMUNICATIONS

Metal–Organic Frameworks for Separations

(2011) Jian-Rong Li et al.   CHEMICAL REVIEWS

Phosphonate Monoesters as Carboxylate-like Linkers for Metal Organic Frameworks

(2011) Simon S. Iremonger et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Adsorption of Ethane, Ethylene, Propane, and Propylene on a Magnesium-Based Metal–Organic Framework

(2011) Zongbi Bao et al.   LANGMUIR

Molecular mechanism of hydrocarbons binding to the metal–organic framework

(2010) Xiuquan Sun et al.   CHEMICAL PHYSICS LETTERS

Grand-Canonical Monte Carlo and Molecular-Dynamics Simulations of Carbon-Dioxide and Carbon-Monoxide Adsorption in Zeolitic Imidazolate Framework Materials

(2010) Andrew Sirjoosingh et al.   Journal of Physical Chemistry C

Methane adsorption in several series of newly synthesised metal-organic frameworks: a molecular simulation study

(2010) Qingguo Ye et al.   MOLECULAR SIMULATION

MOFs, MILs and more: concepts, properties and applications for porous coordination networks (PCNs)

(2010) Christoph Janiak et al.   NEW JOURNAL OF CHEMISTRY

Adsorption of propane, propylene and isobutane on a metal–organic framework: Molecular simulation and experiment

(2009) Nabil Lamia et al.   CHEMICAL ENGINEERING SCIENCE

Molecular simulation of propane/propylene separation on the metal–organic framework CuBTC

(2009) Miguel Jorge et al.   COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS

Potential applications of metal-organic frameworks

(2009) Ryan J. Kuppler et al.   COORDINATION CHEMISTRY REVIEWS