Soft Porous Crystals, Nature Chem, vol.1, pp.695-704, 2009. ,
Industrial Applications of Metal-Organic Frameworks, Chem. Soc. Rev, vol.38, pp.1284-1293, 2009. ,
, Chemistry and Application of Flexible Porous Coordination Polymers. Sci. Technol. Adv. Mater, vol.9, p.14108, 2008.
Hybrid porous solids: past, present, future, Chem. Soc. Rev, vol.38, pp.1380-1399, 2009. ,
,
Flexible Porous Metal-Organic Frameworks for a Controlled Drug Delivery, J. Am. Chem. Soc, vol.130, p.6774, 2008. ,
URL : https://hal.archives-ouvertes.fr/hal-00290827
Flexible (Breathing) Interpenetrated Metal-Organic Frameworks for CO 2 Separation Applications, J. Am. Chem. Soc, vol.130, pp.16842-16843, 2008. ,
Modeling the Effect of Structural Changes during Dynamic Separation Processes on MOFs, Langmuir, vol.27, pp.13064-13071, 2011. ,
Thermodynamic Methods and Models to Study Flexible Metal-Organic Frameworks, ChemPhysChem, vol.12, pp.247-258, 2011. ,
URL : https://hal.archives-ouvertes.fr/hal-02116872
Very Large Breathing Effect in the First Nanoporous Chromium(III)-Based Solids: MIL-53 or CrIII(OH).{O2C-C6H4-CO2}.{HO2C-C6H4-CO2H}x, J. Am. Chem. Soc, vol.124, pp.13519-13526, 2002. ,
Explanation of the Adsorption of Polar Vapors in the Highly Flexible Metal Organic Framework MIL-53(Cr), J Am Chem Soc, vol.132, pp.9488-9498, 2010. ,
URL : https://hal.archives-ouvertes.fr/hal-01840524
Water and Ethanol Desorption in the Flexible Metal Organic Frameworks, MIL-53 (Cr, Fe), Investigated by Complex Impedance Spectrocopy and Density Functional Theory Calculations, Phys Chem Chem Phys, vol.12, 2010. ,
URL : https://hal.archives-ouvertes.fr/hal-00522782
Rapid and Reversible Formation of a Crystalline Hydrate of a Metal-Organic Framework Containing a Tube of Hydrogen-Bonded Water, Chem. Commun, vol.47, pp.713-715, 2011. ,
Molecular Insight into the Adsorption and Diffusion of Water in the Versatile Hydrophilic/Hydrophobic Flexible MIL-53(Cr) MOF, J. Phys. Chem. C, vol.115, pp.10764-10776, 2011. ,
URL : https://hal.archives-ouvertes.fr/hal-00607865
Structure and Dynamics of the Hydrated Metal-Organic Framework MIL-53(Cr) by First-Principles Molecular Dynamics, Phys. Chem. Chem. Phys, vol.15, pp.19049-19056, 2013. ,
Water in Metal-Organic Frameworks: Structure and Diffusion of H 2 O in MIL-53(Cr) from Quantum Simulations, Mol. Simul, vol.38, pp.631-641, 2012. ,
Elucidating the Breathing of the Metal-Organic Framework MIL-53(Sc) with ab Initio Molecular Dynamics Simulations and in Situ X-ray Powder Diffraction Experiments, J. Am. Chem. Soc, vol.135, pp.15763-15773, 2013. ,
, IR Structural Investigations of a Particular Breathing Effect in the MOF-Type Gallium Terephthalate MIL-53(Ga), pp.2241-2249, 2009.
URL : https://hal.archives-ouvertes.fr/hal-01840538
IM-19: A New Flexible Microporous Gallium Based-MOF Framework with Pressure-and Temperature-Dependent Openings, Phys. Chem. Chem. Phys, vol.11, pp.5241-5245, 2009. ,
Temperature-Induced Structural Transitions in the Gallium-Based MIL-53 Metal-Organic Framework, J. Phys. Chem. C, vol.117, pp.8180-8188, 2013. ,
URL : https://hal.archives-ouvertes.fr/hal-02113280
, General Profile and Structure Analysis Software for Powder Diffraction Data, vol.2, 2004.
Evidence of Structural Phase Transitions in Silicalite-1 by Infrared Spectroscopy, J. Chem. Phys, vol.139, 2013. ,
CRYSTAL: a Computational Tool for the Ab Initio Study of the Electronic Properties of Crystals, Z. Kristallogr, vol.220, pp.571-573, 2005. ,
Density-Functional Thermochemistry. III. The Role of Exact Exchange, J. Chem. Phys, vol.98, pp.5648-5652, 1993. ,
Development of the Colle-Salvetti Correlation-Energy Formula Into a Functional of the Electron Density, Phys. Rev. B, vol.37, pp.785-789, 1988. ,
GGA-Type Density Functional Constructed with a Long-Range Dispersion Correction, J. Comput. Chem, vol.27, pp.1787-1799, 2006. ,
Quantum-Mechanical Calculation of the Solid-State Equilibrium MgO+?-Al2O3?MgAl2O4 (Spinel) Versus Pressure, Phys. Rev. B, vol.49, pp.14179-14187, 1994. ,
,
Ab-Initio Study of High-Pressure Phase-Transition in GaN, J. Phys. Chem. Solids, vol.55, pp.1357-1361, 1994. ,
The Calculation of the Vibration Frequencies of Crystalline Compounds and its Implementation in the CRYSTAL Code, J. Comput. Chem, vol.25, pp.888-897, 2004. ,
The Calculation of the Vibration Frequencies of Alpha-Quartz: the Effect of Hamiltonian and Basis Set, J. Comput. Chem, vol.25, pp.1873-1881, 2004. ,
Van der Waals Density Functional for General Geometries, Phys. Rev. Lett, p.246401, 2004. ,
Separable Dual-Space Gaussian Pseudopotentials, Phys. Rev. B, vol.54, pp.1703-1710, 1996. ,
Canonical Sampling Through Velocity Rescaling, J. Chem. Phys, p.14101, 2007. ,
Breathing Transitions in MIL-53(Al) Metal-Organic Framework Upon Xenon Adsorption, Angew. Chem. Int. Ed, vol.48, pp.8314-8317, 2009. ,
URL : https://hal.archives-ouvertes.fr/hal-00548070
Adsorption Induced Transitions in Soft Porous Crystals: An Osmotic Potential Approach to Multistability and Intermediate Structures, J. Chem. Phys, p.174706, 2013. ,
URL : https://hal.archives-ouvertes.fr/hal-02116916
Reversible Structural Transition in MIL-53 with Large Temperature Hysteresis, J Am Chem Soc, vol.130, pp.11813-11818, 2008. ,
The Behavior of Flexible MIL-53(Al) upon CH 4 and CO 2 Adsorption, J. Phys. Chem. C, vol.114, pp.22237-22244, 2010. ,
Flexibility in a Metal-Organic Framework Material Controlled by Weak Dispersion Forces: The Bistability of MIL-53(Al), Angew. Chem. Intl. Ed, vol.49, pp.7501-7503, 2010. ,
Dispersion-Driven Conformational Isomerism in ?-Bonded Dimers of Larger Acenes, Angew. Chem. Int. Ed, vol.41, pp.10892-10895, 2013. ,
Anisotropic Elastic Properties of Flexible Metal-Organic Frameworks: How Soft Are Soft Porous Crystals?, Phys. Rev. Lett, vol.109, p.195502, 2012. ,
Mechanism of Breathing Transitions in Metal-Organic Frameworks, J. Phy. Chem. Lett, vol.2, pp.2033-2037, 2011. ,
URL : https://hal.archives-ouvertes.fr/hal-02113294
Physics Behind the Guest-Assisted Structural Transitions of a Porous Metal-Organic Framework Material, J. Phy. Chem. Lett, vol.1, pp.2810-2815, 2010. ,
URL : https://hal.archives-ouvertes.fr/hal-00518346
The osmotic framework adsorbed solution theory: predicting mixture coadsorption in flexible nanoporous materials, Phys. Chem. Chem. Phys, vol.12, pp.10904-10913, 2010. ,
URL : https://hal.archives-ouvertes.fr/hal-00548066
Effect of the nature of the metal on the breathing steps in MOFs with dynamic frameworks, Chem. Commun, pp.4732-4734, 2008. ,