Cargando…
Crystals springing into action: metal–organic framework CUK-1 as a pressure-driven molecular spring
Mercury porosimetry and in situ high pressure single crystal X-ray diffraction revealed the wine-rack CUK-1 MOF as a unique crystalline material capable of a fully reversible mechanical pressure-triggered structural contraction. The near-absence of hysteresis upon cycling exhibited by this robust MO...
Autores principales: | Iacomi, Paul, Lee, Ji Sun, Vanduyfhuys, Louis, Cho, Kyung Ho, Fertey, Pierre, Wieme, Jelle, Granier, Dominique, Maurin, Guillaume, Van Speybroeck, Veronique, Chang, Jong-San, Yot, Pascal G. |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2021
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8179595/ https://www.ncbi.nlm.nih.gov/pubmed/34163779 http://dx.doi.org/10.1039/d1sc00205h |
Ejemplares similares
-
Thermal Engineering of Metal–Organic Frameworks
for Adsorption Applications: A Molecular Simulation Perspective
por: Wieme, Jelle, et al.
Publicado: (2019) -
Extension of the QuickFF force field protocol for an improved accuracy of structural, vibrational, mechanical and thermal properties of metal–organic frameworks
por: Vanduyfhuys, Louis, et al.
Publicado: (2018) -
Efficient Construction of Free Energy Profiles of
Breathing Metal–Organic Frameworks Using Advanced Molecular
Dynamics Simulations
por: Demuynck, Ruben, et al.
Publicado: (2017) -
Thermodynamic Insight in the High-Pressure Behavior
of UiO-66: Effect of Linker Defects and Linker Expansion
por: Rogge, Sven M. J., et al.
Publicado: (2016) -
Protocol for Identifying Accurate Collective Variables
in Enhanced Molecular Dynamics Simulations for the Description of
Structural Transformations in Flexible Metal–Organic Frameworks
por: Demuynck, Ruben, et al.
Publicado: (2018)