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On the Thermodynamics of Framework Breathing: A Free Energy Model for Gas Adsorption in MIL-53
Online Contents | 2013| -
Comparing normal modes across different models and scales: Hessian reduction versus coarse‐graining
Online Contents | 2012| -
Host–guest and guest–guest interactions between xylene isomers confined in the MIL-47(V) pore system
Online Contents | 2012| -
Oxygen Storage in Stacked Phospholipid Membranes Under an Oxygen Gradient as a Model for Myelin Sheaths
British Library Conference Proceedings | 2022| -
Comparative study of various normal mode analysis techniques based on partial Hessians
Online Contents | 2010| -
Capric Acid and Myristic Acid Permeability Enhancers in Curved Liposome Membranes
American Chemical Society | 2023| -
Position-Dependent Diffusion Tensors in Anisotropic Media from Simulation: Oxygen Transport in and through Membranes
American Chemical Society | 2017| -
Permeation Rates of Oxygen through a Lipid Bilayer Using Replica Exchange Transition Interface Sampling
American Chemical Society | 2021| -
TAMkin: A Versatile Package for Vibrational Analysis and Chemical Kinetics
American Chemical Society | 2010| -
On the Thermodynamics of Framework Breathing: A Free Energy Model for Gas Adsorption in MIL-53
American Chemical Society | 2013| -
Mechanical Properties from Periodic Plane Wave Quantum Mechanical Codes: The Challenge of the Flexible Nanoporous MIL-47(V) Framework
American Chemical Society | 2015| -
Monte Carlo simulations to understand 'breathing' phenomenon of metal organic frameworks
Free accessBASE | 2011|
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