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Adsorption and Diffusion of H-2 in the MOF Type Systems MIL-47(V) and MIL-53(Cr): A Combination of Microcalorimetry and QENS Experiments with Molecular Simulations
F. Salles
,
D. I. Kolokolov
,
H. Jobic
,
Guillaume Maurin
,
P. L. Llewellyn
,
et al.
Journal articles
hal-00430909v1
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Effect of the ligand functionalization on the acid-base properties of flexible MOFs
Béatrice Moulin
,
Fabrice Salles
,
Sandrine Bourrelly
,
P. L. Llewellyn
,
Thomas Devic
,
et al.
Journal articles
hal-01064278v1
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On the breathing effect of the Aluminum Terephtalate MIL-53 upon CO2 adsorption : A computational study compared to experiments
Naseem Ramsahye
,
Guillaume Maurin
,
S. Bourrelly P. Llewellyn
,
Thierry Loiseau
,
Christian Serre
,
et al.
Journal articles
istex
hal-00185384v1
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Transport Diffusivity of CO2 in the Highly Flexible Metal-Organic Framework MIL-53(Cr)
Fabrice Salles
,
Hervé Jobic
,
Aziz Ghoufi
,
P. L. Llewellyn
,
C. Serre
,
et al.
Journal articles
istex
hal-00474365v1
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Influence of the Organic Ligand Functionalization on the Breathing of the Porous Iron Terephthalate Metal Organic Framework Type Material upon Hydrocarbon Adsorption
Naseem Ramsahye
,
Thuy Khuong Trung
,
Sandrine Bourrelly
,
Qingyuan Yang
,
Thomas Devic
,
et al.
Journal articles
hal-00632895v1
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Computational exploration of the gas adsorption on the iron tetracarboxylate metal-organic framework MIL-102
D. Damasceno Borges
,
M. Prakash
,
N.A. Ramsahye
,
P. Llewellyn
,
S. Surblé
,
et al.
Journal articles
hal-01417363v1
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Adsorption of Small Molecules in the Porous Zirconium-Based Metal Organic Framework MIL-140A (Zr): A Joint Computational-Experimental Approach
C. Vieira Soares
,
D. Damasceno Borges
,
A. Wiersum
,
C. Martineau
,
F. Nouar
,
et al.
Journal articles
hal-01477509v1
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Influence of [Mo6Br8F6]2- cluster unit inclusion within the mesoporous solid MIL-101 on hydrogen storage performance.
Danil Dybtsev
,
Christian Serre
,
Barbara Schmitz
,
Barbara Panella
,
Michael Hirscher
,
et al.
Journal articles
hal-00831632v1
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Screening the Effect of Water Vapour on Gas Adsorption Performance: Application to CO 2 Capture from Flue Gas in Metal-Organic Frameworks
Nicolas Chanut
,
Sandrine Bourrelly
,
Bogdan Kuchta
,
Christian Serre
,
Jong-San Chang
,
et al.
Journal articles
hal-01582004v1
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Complex Adsorption of Short Linear Alkanes in the Flexible Metal-Organic-Framework MIL-53(Fe)
P. L. Llewellyn
,
Patricia Horcajada
,
Guillaume Maurin
,
Thomas Devic
,
Nilton Rosenbach
,
et al.
Journal articles
hal-00474363v1
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Predicting the flexibility of MOF systems from thermodynamic criteria : combination of microcalorimetry and molecular simulations to follow the adsorption behaviour of C1-C4 hydrocarbons and carbon dioxide in MIL-53-Cr
P. L. Llewellyn
,
Guillaume Maurin
,
Nilton Rosenbach
,
Sandrine Bourrelly
,
Thomas Devic
,
et al.
Journal articles
istex
hal-00335188v1
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Combined Quasi-Elastic Neutron Scattering and Molecular Dynamics study of methane diffusion in Metal Organic Frameworks MIL-47(V) and MIL-53(Cr),
Nilton Rosenbach
,
Hervé Jobic
,
Aziz Ghoufi
,
Fabrice Salles
,
Guillaume Maurin
,
et al.
Journal articles
hal-00335180v1
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Adsorption of CO2 in metal organic frameworks of different metal centres: Grand Canonical Monte Carlo simulations compared to experiments
Naseem Ramsahye
,
Guillaume Maurin
,
Sandrine Bourrelly
,
Philip L. Llewellyn
,
Thomas Devic
,
et al.
Journal articles
istex
hal-00354526v1
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How Water Fosters a Remarkable 5-Fold Increase in Low-Pressure CO2 Uptake within Mesoporous MIL-100(Fe)
Estelle Soubeyrand-Lenoir
,
Christelle Vagner
,
Ji Woong Yoon
,
Philippe Bazin
,
Florence Ragon
,
et al.
Journal of the American Chemical Society, 2012, 134 (24), pp.10174--10181
Journal articles
hal-01840357v1
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Revisiting the Aluminum Trimesate-based MOF (MIL-96): from Structure Determination to the Processing of Mixed Matrix Membranes for CO2 Capture.
Marvin Benzaqui
,
Renjith S. Pillai
,
Anahid Sabetghadam
,
Virginie Benoit
,
Périne Normand
,
et al.
Journal articles
hal-01649037v1
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Molecular Insight into the Adsorption and Diffusion of Water in the Versatile Hydrophilic/Hydrophobic Flexible MIL-53(Cr) MOF
Fabrice Salles
,
Sandrine Bourrelly
,
Hervé Jobic
,
Thomas Devic
,
V. Guillerm
,
et al.
Journal articles
hal-00607865v1
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Functionalizing porous zirconium terephthalate UiO-66(Zr) for natural gas upgrading: A computational exploration
Q.Y. Yang
,
Andrew Wiersum
,
P. L. Llewellyn
,
V. Guillerm
,
C. Serre
,
et al.
Journal articles
hal-00607908v1
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A multidisciplinary approach to understanding sorption induced breathing in the metal organic framework MIL53(Cr)
Sandrine Bourrelly
,
P. L. Llewellyn
,
Alexandre Vimont
,
Naseem Ramsahye
,
Guillaume Maurin
,
et al.
Journal articles
hal-00185531v1
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Direct accessibility of mixed-metal (III/II) acid sites through the rational synthesis of porous metal carboxylates
S. Wongsakulphasatch
,
F. Nouar
,
J. Rodriguez
,
L. Scott
,
Clément Leguillouzer
,
et al.
Journal articles
hal-01840207v1
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A robust amino-functionalized titanium(IV) based MOF for improved separation of acid gases
Sebastien Vaesen
,
Vincent Guillerm
,
Qingyuan Yang
,
Andrew D Wiersum
,
Bartosz Marszalek
,
et al.
Journal articles
hal-01840301v1
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A Robust Infinite Zirconium Phenolate Building Unit to Enhance the Chemical Stability of Zr MOFs
Georges Mouchaham
,
Lucy Cooper
,
Nathalie Guillou
,
Charlotte Martineau
,
Erik Elkaïm
,
et al.
Journal articles
istex
hal-01416642v1
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How Reproducible are Surface Areas Calculated from the BET Equation?
Johannes Osterrieth
,
James Rampersad
,
David Madden
,
Nakul Rampal
,
Luka Skoric
,
et al.
Journal articles
hal-03677646v2
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Multistep N-2 Breathing in the Metal-Organic Framework Co(1,4-benzenedipyrazolate)
Fabrice Salles
,
Guillaume Maurin
,
Christian Serre
,
Philip L Llewellyn
,
Christina Knoefel
,
et al.
Journal articles
hal-01840504v1
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Observing the Effects of Shaping on Gas Adsorption in Metal Organic Frameworks
Chanut Nicolas
,
Andrew Wiersum
,
U-Hwang Lee
,
Young Kyu Hwang
,
Florence Ragon
,
et al.
Journal articles
hal-01465949v1
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Evaluation of MIL-47(V) for CO2-Related Applications
P. L. Llewellyn
,
Sandrine Bourrelly
,
Christelle Vagner
,
Nicolas Heymans
,
Hervé Leclerc
,
et al.
Journal articles
hal-00777354v1
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Probing the adsorption sites for CO2 in MIL-53(Al,Cr) and MIL-47(V) Metal Organic Framework materials by Density Functional Theory
Naseem Ramsahye
,
Guillaume Maurin
,
Sandrine Bourrelly
,
P. L. Llewellyn
,
Thierry Loiseau
,
et al.
Journal articles
istex
hal-00290818v1
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Separation of CO2/CH4 mixtures in the mesoporous MIL-100(Cr) MOF : experimental and modelling approaches
Lomig Hamon
,
Nicolas Heymans
,
P. L. Llewellyn
,
V. Guillerm
,
Aziz Ghoufi
,
et al.
Journal articles
hal-00714283v1
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Self and Transport Diffusivity of CO2 in the Metal-Organic Framework MIL-47(V) Explored by Quasi-elastic Neutron Scattering Experiments and Molecular Dynamics Simulations
Fabrice Salles
,
Hervé Jobic
,
Thomas Devic
,
P. L. Llewellyn
,
C. Serre
,
et al.
Journal articles
hal-00474848v1
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A promising metal–organic framework (MOF), MIL-96(Al), for CO 2 separation under humid conditions
Virginie Benoit
,
Nicolas Chanut
,
Renjith Pillai
,
Marvin Benzaqui
,
Isabelle Beurroies
,
et al.
Journal articles
hal-01710539v1
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Using Pressure to Provoke the Structural Transition of Metal–Organic Frameworks
Isabelle Beurroies
,
Mohammed Boulhout
,
Philip L. Llewellyn
,
Bogdan Kuchta
,
Gérard Féray
,
et al.
Journal articles
istex
hal-01465940v1
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