Thermodynamic insight into stimuli-responsive behaviour of soft porous crystals

Probing Dielectric Properties of Metal–Organic Frameworks: MIL-53(Al) as a Model System for Theoretical Predictions and Experimental Measurements via Synchrotron Far- and Mid-Infrared Spectroscopy

(2017) Kirill Titov et al.   Journal of Physical Chemistry Letters

Electrically Induced Breathing of the MIL-53(Cr) Metal–Organic Framework

(2017) Aziz Ghoufi et al.   ACS Central Science

A Computational and Experimental Approach Linking Disorder, High-Pressure Behavior, and Mechanical Properties in UiO Frameworks

(2016) Claire L. Hobday et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Thermodynamic Insight in the High-Pressure Behavior of UiO-66: Effect of Linker Defects and Linker Expansion

(2016) Sven M. J. Rogge et al.   CHEMISTRY OF MATERIALS

Exploration of the mechanical behavior of metal organic frameworks UiO-66(Zr) and MIL-125(Ti) and their NH2 functionalized versions

(2016) Pascal. G. Yot et al.   DALTON TRANSACTIONS

Minimal Basis Iterative Stockholder: Atoms in Molecules for Force-Field Development

(2016) Toon Verstraelen et al.   Journal of Chemical Theory and Computation

Exploring the Flexibility of MIL-47(V)-Type Materials Using Force Field Molecular Dynamics Simulations

(2016) J. Wieme et al.   Journal of Physical Chemistry C

Systematic study of the chemical and hydrothermal stability of selected “stable” Metal Organic Frameworks

(2016) Karen Leus et al.   MICROPOROUS AND MESOPOROUS MATERIALS

A pressure-amplifying framework material with negative gas adsorption transitions

(2016) Simon Krause et al.   NATURE

Interplay between defects, disorder and flexibility in metal-organic frameworks

(2016) Thomas D. Bennett et al.   Nature Chemistry

Wavelike charge density fluctuations and van der Waals interactions at the nanoscale

(2016) Alberto Ambrosetti et al.   SCIENCE

Mechanical energy storage performance of an aluminum fumarate metal–organic framework

(2016) Pascal G. Yot et al.   Chemical Science

Origins of Negative Gas Adsorption

(2016) Jack D. Evans et al.   Chem

The Structure of the Aluminum Fumarate Metal-Organic Framework A520

(2015) Elsa Alvarez et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Responsive Metal–Organic Frameworks and Framework Materials: Under Pressure, Taking the Heat, in the Spotlight, with Friends

(2015) François-Xavier Coudert   CHEMISTRY OF MATERIALS

Experimental evidence of negative linear compressibility in the MIL-53 metal–organic framework family

(2015) Pablo Serra-Crespo et al.   CRYSTENGCOMM

A Comparison of Barostats for the Mechanical Characterization of Metal–Organic Frameworks

(2015) S.M.J. Rogge et al.   Journal of Chemical Theory and Computation

QuickFF: A program for a quick and easy derivation of force fields for metal-organic frameworks fromab initioinput

(2015) Louis Vanduyfhuys et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Solid-State Reversible Nucleophilic Addition in a Highly Flexible MOF

(2015) Arianna Lanza et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Semi-analytical mean-field model for predicting breathing in metal–organic frameworks

(2015) L. Vanduyfhuys et al.   MOLECULAR SIMULATION

Methane storage in flexible metal–organic frameworks with intrinsic thermal management

(2015) Jarad A. Mason et al.   NATURE

Amorphous Metal–Organic Frameworks

(2014) Thomas D. Bennett et al.   ACCOUNTS OF CHEMICAL RESEARCH

Prediction of flexibility of metal–organic frameworks CAU-13 and NOTT-300 by first principles molecular simulations

(2014) Aurélie U. Ortiz et al.   CHEMICAL COMMUNICATIONS

Metal–organic frameworks as potential shock absorbers: the case of the highly flexible MIL-53(Al)

(2014) Pascal G. Yot et al.   CHEMICAL COMMUNICATIONS

Flexible metal–organic frameworks

(2014) A. Schneemann et al.   CHEMICAL SOCIETY REVIEWS

Contradistinct Thermoresponsive Behavior of Isostructural MIL-53 Type Metal–Organic Frameworks by Modifying the Framework Inorganic Anion

(2014) Chompoonoot Nanthamathee et al.   CHEMISTRY OF MATERIALS

On the Thermodynamics of Framework Breathing: A Free Energy Model for Gas Adsorption in MIL-53

(2013) An Ghysels et al.   Journal of Physical Chemistry C

Homologous Critical Behavior in the Molecular Frameworks Zn(CN)2 and Cd(imidazolate)2

(2013) Ines E. Collings et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Effects of pelletization pressure on the physical and chemical properties of the metal–organic frameworks Cu3(BTC)2 and UiO-66

(2013) Gregory W. Peterson et al.   MICROPOROUS AND MESOPOROUS MATERIALS

A highly porous metal–organic framework, constructed from a cuboctahedral super-molecular building block, with exceptionally high methane uptake

(2012) Ulrich Stoeck et al.   CHEMICAL COMMUNICATIONS

Molecular-Level Characterization of the Breathing Behavior of the Jungle-Gym-type DMOF-1 Metal–Organic Framework

(2012) Jason S. Grosch et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Directing the Breathing Behavior of Pillared-Layered Metal–Organic Frameworks via a Systematic Library of Functionalized Linkers Bearing Flexible Substituents

(2012) Sebastian Henke et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

van der Waals Bonding in Layered Compounds from Advanced Density-Functional First-Principles Calculations

(2012) T. Björkman et al.   PHYSICAL REVIEW LETTERS

Anisotropic Elastic Properties of Flexible Metal-Organic Frameworks: How Soft are Soft Porous Crystals?

(2012) Aurélie U. Ortiz et al.   PHYSICAL REVIEW LETTERS

Disclosing the Complex Structure of UiO-66 Metal Organic Framework: A Synergic Combination of Experiment and Theory

(2011) Loredana Valenzano et al.   CHEMISTRY OF MATERIALS

Structural Chemistry, Monoclinic-to-Orthorhombic Phase Transition, and CO2Adsorption Behavior of the Small Pore Scandium Terephthalate, Sc2(O2CC6H4CO2)3, and Its Nitro- And Amino-Functionalized Derivatives

(2011) John P. S. Mowat et al.   INORGANIC CHEMISTRY

Structural Transitions in MIL-53 (Cr): View from Outside and Inside

(2011) Alexander V. Neimark et al.   LANGMUIR

Synthesis and crystal chemistry of the STA-12 family of metal N,N′-piperazinebis(methylenephosphonate)s and applications of STA-12(Ni) in the separation of gases

(2011) Michael T. Wharmby et al.   MICROPOROUS AND MESOPOROUS MATERIALS

Large breathing of the MOF MIL-47(VIV) under mechanical pressure: a joint experimental–modelling exploration

(2011) Pascal G. Yot et al.   Chemical Science

Using Pressure to Provoke the Structural Transition of Metal-Organic Frameworks

(2010) Isabelle Beurroies et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Breathing Transitions in MIL-53(Al) Metal-Organic Framework Upon Xenon Adsorption

(2009) Anne Boutin et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Large breathing effects in three-dimensional porous hybrid matter: facts, analyses, rules and consequences

(2009) Gérard Férey et al.   CHEMICAL SOCIETY REVIEWS

Soft porous crystals

(2009) Satoshi Horike et al.   Nature Chemistry

IM-19: a new flexible microporous gallium based-MOF framework with pressure- and temperature-dependent openings

(2009) Gérald Chaplais et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Reversible Structural Transition in MIL-53 with Large Temperature Hysteresis

(2008) Yun Liu et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Broadly Hysteretic H2Adsorption in the Microporous Metal−Organic Framework Co(1,4-benzenedipyrazolate)

(2008) Hye Jin Choi et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Hybrid porous solids: past, present, future

(2007) Gérard Férey   CHEMICAL SOCIETY REVIEWS