标题
The role of molecular modeling in confined systems: impact and prospects
作者
关键词
-
出版物
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Volume 13, Issue 1, Pages 58-85
出版商
Royal Society of Chemistry (RSC)
发表日期
2010-11-30
DOI
10.1039/c0cp01475c
参考文献
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注意:仅列出部分参考文献,下载原文获取全部文献信息。- Single-File Diffusion of Confined Water Inside SWNTs: An NMR Study
- (2010) Anindya Das et al. ACS Nano
- Transition from single-file to Fickian diffusion for binary mixtures in single-walled carbon nanotubes
- (2010) Qu Chen et al. JOURNAL OF CHEMICAL PHYSICS
- Dual diffusion mechanism of argon confined in single-walled carbon nanotube bundles
- (2010) Ying-Chun Liu et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Mass Transfer in a Nanoscale Material Enhanced by an Opposing Flux
- (2010) Christian Chmelik et al. PHYSICAL REVIEW LETTERS
- Behavior of ethylene and ethane within single-walled carbon nanotubes, 2: dynamical properties
- (2009) Fernando J. A. L. Cruz et al. ADSORPTION-JOURNAL OF THE INTERNATIONAL ADSORPTION SOCIETY
- Adsorption and diffusion of argon confined in ordered and disordered microporous carbons
- (2009) Joshua D. Moore et al. APPLIED SURFACE SCIENCE
- Quenched solid density functional theory and pore size analysis of micro-mesoporous carbons
- (2009) Alexander V. Neimark et al. CARBON
- Modeling the structural evolution of carbide-derived carbons using quenched molecular dynamics
- (2009) J.C. Palmer et al. CARBON
- Unified Maxwell–Stefan description of binary mixture diffusion in micro- and meso-porous materials
- (2009) R. Krishna et al. CHEMICAL ENGINEERING SCIENCE
- An efficient algorithm for the density-functional theory treatment of dispersion interactions
- (2009) Jürgen Gräfenstein et al. JOURNAL OF CHEMICAL PHYSICS
- Accurate interaction energies at density functional theory level by means of an efficient dispersion correction
- (2009) Alisa Krishtal et al. JOURNAL OF CHEMICAL PHYSICS
- Fluctuation theory of single-file diffusion
- (2009) B. U. Felderhof JOURNAL OF CHEMICAL PHYSICS
- Normal and anomalous diffusion in highly confined hard disk fluid mixtures
- (2009) C. D. Ball et al. JOURNAL OF CHEMICAL PHYSICS
- A Simple Two-Dimensional NLDFT Model of Gas Adsorption in Finite Carbon Pores. Application to Pore Structure Analysis
- (2009) Jacek Jagiello et al. Journal of Physical Chemistry C
- Stress-Based Model for the Breathing of Metal−Organic Frameworks
- (2009) Alexander V. Neimark et al. Journal of Physical Chemistry Letters
- Predicting Gas Adsorption in Complex Microporous and Mesoporous Materials Using a New Density Functional Theory of Finely Discretized Lattice Fluids
- (2009) Daniel W. Siderius et al. LANGMUIR
- Sorption strain as a packing phenomenon
- (2009) Gerrit Günther et al. PHYSICAL CHEMISTRY CHEMICAL PHYSICS
- Fluctuation Theorems
- (2008) E.M. Sevick et al. Annual Review of Physical Chemistry
- An investigation of the characteristics of Maxwell–Stefan diffusivities of binary mixtures in silica nanopores
- (2008) R. Krishna et al. CHEMICAL ENGINEERING SCIENCE
- Molecular Simulations of Zeolites: Adsorption, Diffusion, and Shape Selectivity
- (2008) Berend Smit et al. CHEMICAL REVIEWS
- A remarkable shape-catalytic effect of confinement on the rotational isomerization of small hydrocarbons
- (2008) Erik E. Santiso et al. JOURNAL OF CHEMICAL PHYSICS
- Simulation of chemical reaction equilibria by the reaction ensemble Monte Carlo method: a review†
- (2008) C. Heath Turner et al. MOLECULAR SIMULATION
- Novel Insights into Nanopore Deformation Caused by Capillary Condensation
- (2008) Gerrit Günther et al. PHYSICAL REVIEW LETTERS
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