相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。QuickFF: A Program for a Quick and Easy Derivation of Force Fields for Metal-Organic Frameworks from Ab Initio Input
Louis Vanduyfhuys et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2015)
Metal-organic frameworks as potential shock absorbers: the case of the highly flexible MIL-53(Al)
Pascal G. Yot et al.
CHEMICAL COMMUNICATIONS (2014)
Flexible metal-organic frameworks
A. Schneemann et al.
CHEMICAL SOCIETY REVIEWS (2014)
Extension of the Universal Force Field to Metal-Organic Frameworks
Matthew A. Addicoat et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2014)
A thermodynamic description of the adsorption-induced structural transitions in flexible MIL-53 metal-organic framework
Francois-Xavier Coudert et al.
MOLECULAR PHYSICS (2014)
Adsorption induced transitions in soft porous crystals: An osmotic potential approach to multistability and intermediate structures
David Bousquet et al.
JOURNAL OF CHEMICAL PHYSICS (2013)
Temperature-Induced Structural Transitions in the Gallium-Based MIL-53 Metal-Organic Framework
Anne Boutin et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2013)
On the Thermodynamics of Framework Breathing: A Free Energy Model for Gas Adsorption in MIL-53
An Ghysels et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2013)
MOF-FF - A flexible first-principles derived force field for metal-organic frameworks
Sareeya Bureekaew et al.
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS (2013)
Free energy landscapes for the thermodynamic understanding of adsorption-induced deformations and structural transitions in porous materials
D. Bousquet et al.
JOURNAL OF CHEMICAL PHYSICS (2012)
Ab Initio Parametrized Force Field for the Flexible Metal-Organic Framework MIL-53(Al)
L. Vanduyfhuys et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2012)
Comparative Guest, Thermal, and Mechanical Breathing of the Porous Metal Organic Framework MIL-53(Cr): A Computational Exploration Supported by Experiments
A. Ghoufi et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2012)
Mechanism of Breathing Transitions in Metal-Organic Frameworks
Carles Triguero et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2011)
Stress-Based Model for the Breathing of Metal-Organic Frameworks
Alexander V. Neimark et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2010)
Cover Picture: The Nature of the Extraordinary Finish of Stradivari’s Instruments (Angew. Chem. Int. Ed. 1/2010)
Jean-Philippe Echard et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2009)
Breathing Transitions in MIL-53(Al) Metal-Organic Framework Upon Xenon Adsorption
Anne Boutin et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2009)
Estimation of the breathing energy of flexible MOFs by combining TGA and DSC techniques
Sabine Devautour-Vinot et al.
CHEMICAL COMMUNICATIONS (2009)
Large breathing effects in three-dimensional porous hybrid matter: facts, analyses, rules and consequences
Gerard Ferey et al.
CHEMICAL SOCIETY REVIEWS (2009)
XRD and IR structural investigations of a particular breathing effect in the MOF-type gallium terephthalate MIL-53(Ga)
Christophe Volkringer et al.
DALTON TRANSACTIONS (2009)
Sorption-Induced Breathing in the Flexible Metal Organic Framework CrMIL-53: Force-Field Simulations and Electronic Structure Analysis
David S. Coombes et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2009)
Reversible structural transition in MIL-53 with large temperature hysteresis
Yun Liu et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Prediction of the conditions for breathing of metal organic framework materials using a combination of X-ray powder diffraction, microcalorimetry, and molecular simulation
Philip L. Llewellyn et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Thermodynamics of Guest-induced Structural Transitions in Hybrid Organic-Inorganic Frameworks
Francois-Xavier Coudert et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Metal-organic frameworks with exceptionally high capacity for storage of carbon dioxide at room temperature
AR Millward et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2005)
A rationale for the large breathing of the porous aluminum terephthalate (MIL-53) upon hydration
T Loiseau et al.
CHEMISTRY-A EUROPEAN JOURNAL (2004)
Functional porous coordination polymers
S Kitagawa et al.
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2004)
Very large breathing effect in the first nanoporous chromium(III)-based solids:: MIL-53 or CrIII(OH)•{O2C-C6H4-CO2}•{HO2C-C6H4-CO2H}x•H2Oy
C Serre et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2002)