✦ LIBER ✦

Molecular Simulation Study of Hexane Diffusion in Dynamic Metal-Organic Frameworks

✍ Scribed by Chunyu XUE; Chongli ZHONG

Publisher: John Wiley and Sons
Year: 2009
Tongue: English
Weight: 335 KB
Volume: 27
Category: Article
ISSN: 0256-7660
DOI: 10.1002/cjoc.200990077

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Quasi-Elastic Neutron Scattering and Mol

Quasi-Elastic Neutron Scattering and Molecular Dynamics Study of Methane Diffusion in Metal Organic Frameworks MIL-47(V) and MIL-53(Cr)

✍ Nilton Rosenbach Jr.; Hervé Jobic; Aziz Ghoufi; Fabrice Salles; Guillaume Maurin 📂 Article 📅 2008 🏛 John Wiley and Sons 🌐 English ⚖ 427 KB 👁 2 views

Quasi-Elastic Neutron Scattering and Mol

Quasi-Elastic Neutron Scattering and Molecular Dynamics Study of Methane Diffusion in Metal Organic Frameworks MIL-47(V) and MIL-53(Cr)

✍ Nilton Rosenbach Jr.; Hervé Jobic; Aziz Ghoufi; Fabrice Salles; Guillaume Maurin 📂 Article 📅 2008 🏛 John Wiley and Sons 🌐 English ⚖ 427 KB 👁 2 views

Desorption Studies of Hydrogen in Metal–

Desorption Studies of Hydrogen in Metal–Organic Frameworks

✍ Barbara Panella; Katja Hönes; Ulrich Müller; Natalia Trukhan; Markus Schubert; H 📂 Article 📅 2008 🏛 John Wiley and Sons 🌐 English ⚖ 324 KB

ChemInform Abstract: Recent Advances on

ChemInform Abstract: Recent Advances on Simulation and Theory of Hydrogen Storage in Metal—Organic Frameworks and Covalent Organic Frameworks

✍ Sang Soo Han; Jose L. Mendoza-Cortes; William A. III Goddard 📂 Article 📅 2009 🏛 John Wiley and Sons ⚖ 15 KB 👁 2 views

Study of the electrostatics treatment in

Study of the electrostatics treatment in molecular dynamics simulations

✍ Robert Garemyr; Arne Elofsson 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 355 KB 👁 3 views

This article considers the treatment of long-range interactions in molecular dynamics simulations. We investigate the effects of using different cutoff distances, constant versus distancedependent dielectric, and different smoothing methods. In contrast to findings of earlier studies, we find that i

ChemInform Abstract: Molecular Dynamics

ChemInform Abstract: Molecular Dynamics Simulations of Stability of Metal—Organic Frameworks Against H2O Using the ReaxFF Reactive Force Field.

✍ Sang Soo Han; Seung-Hoon Choi; Adri C. T. van Duin 📂 Article 📅 2010 🏛 John Wiley and Sons ⚖ 17 KB 👁 1 views