A5033051862- Membrane Separation and Gas Transport
- Phase Equilibria and Thermodynamics
- Carbon Dioxide Capture Technologies
- Covalent Organic Framework Applications
- Thermodynamic properties of mixtures
- Zeolite Catalysis and Synthesis
- Spectroscopy and Quantum Chemical Studies
- Conducting polymers and applications
- Muon and positron interactions and applications
- Metal-Organic Frameworks: Synthesis and Applications
- Catalysis and Oxidation Reactions
- Material Dynamics and Properties
- Supercapacitor Materials and Fabrication
- Fuel Cells and Related Materials
- Advanced Battery Materials and Technologies
University of Kansas
2014-2018
Virginia Tech
2011-2013
A major challenge in the molecular simulation of electric double layer capacitors (EDLCs) is choice an appropriate model for electrode. Typically, such simulations electrode surface modeled using a uniform fixed charge on each atoms, which ignores response to local fluctuations electrolyte solution. In this work, we evaluate and compare Fixed Charge Method (FCM) with more realistic Constant Potential (CPM), [S. K. Reed et al., J. Chem. Phys. 126, 084704 (2007)], charges fluctuate order...
Hybrid organic-inorganic H2-selective membranes consisting of single-layer or dual-layers silica incorporating aromatic groups are deposited on a porous alumina support by chemical vapor deposition (CVD) in an inert atmosphere at high temperature. The membranes, which made the simultaneous decomposition phenyltriethoxysilane (PTES) and tetraethylorthosilicate (TEOS), have good hydrothermal stability temperature permeance for hydrogen order 10−7 mol m−2 s−1 Pa−1 873 K, while preventing...
A general mixed mechanism model formulated within a grid framework is proposed. In particular, the employed to account for variability in diffusion of carbon dioxide and methane certain class inorganic–organic membranes. This basis separation gas mixtures into various components. Various sizes cells are developed series hybrid Parameters each estimated from permeance results both methane. Acceptable models determined by comparing parameters surface with values reported open literature. For...