Here you will find presentations given at COMSOL Conferences around the globe. The presentations explore the innovative research and products designed by your peers using COMSOL Multiphysics. Research topics span a wide array of industries and application areas, including the electrical, mechanical, fluid, and chemical disciplines. Use the Quick Search to find presentations pertaining to your application area.

COMSOL Multiphysics® Simulations of Graphene Chemical Vapor Deposition (CVD) Growth - new

K. M. Al-Shurman[1], H. Naseem[1]
[1]The Institute for Nanoscience & Engineering, University of Arkansas, Fayetteville, AR, USA

Chemical vapor deposition (CVD) is a promising effective method for synthesis of graphene films. CVD graphene film is obtained from hydrocarbon species such as CH4 through complex catalytic chemical reactions on the surface of the catalyst. Therefore, studying the catalytic reaction kinetics is essential process for understanding the thermal decomposition rate of methane on catalyst surface as ...

Water Quality Modeling of Drinking Water Storage Reservoir Noardburgum

N. Wolthek[1]
[1]Vitens NV, Zwolle, The Netherlands

The water storage reservoir at the WTP Noardburgum is used to even out demand and supply and ensure a stable drinking water production capacity. At the moment the rectangular reservoir has a single pipeline which serves as an inlet during the fill cycle and as an outlet during the draw cycle. This study aims to examine the current mixing characteristics of the reservoir and to investigate ...

A Wall-Cooled Fixed-Bed Reactor Model for Gas-Phase Fischer-Tropsch Synthesis

A. Nanduri [1], P. L. Mills [1],
[1] Department of Chemical and Natural Gas Engineering, Texas A&M University - Kingsville, Kingsville, TX, USA

In the early 1920’s, Gas-To-Liquids (GTL) and Coal-To-Liquids (CTL) technologies were developed to account for the depleting crude oil resources [1]. During this period, Franz Fischer and Hans Tropsch developed a process to convert synthesis gas (syn gas), derived from coal gasification, to a wide range of high value-added products. This process later came to be known as Fischer-Tropsch (F-T) ...

Ammonia Removal From Water by a Liquid-Liquid Membrane Contactor Under a Closed Loop Regime

E. Licon[1], S. Casas[1], A. Alcaraz[1], J.L. Cortina[1], C. Valderrama[1]
[1]Universitat Politécnica de Catalunya, Barcelona, Spain

Ammonia separation from water by membrane contactor was simulated on transient state and compared with experimental data. Aqueous low concentrated solution of ammonium with high pH has been pumped inside the hydrophobic hollow fibers, acid solution in the outside part. The system is in closed loop configuration. In order to simulate the separation process, equations were developed considering ...

COMSOL Multiphysics® Simulation of Flow in a Radial Flow Fixed Bed Reactor (RFBR)

A. G. Dixon [1], D. S. Polcari [1], A. D. Stolo [1], M. Tomida [1],
[1] Department of Chemical Engineering, Worcester Polytechnic Institute, Worcester, MA, USA

For design of radial flow fixed bed reactors, it is important to ensure proper flow distribution through the catalyst bed. A 2D axisymmetric model of a radial-flow reactor was used to evaluate flow maldistribution through the catalyst bed and the pressure drop through the reactor for a specified flow rate. Effects of different catalysts, screen sizes and flow direction were simulated. Factors ...

Lennard-Jones Potential Determination via the Time-Dependent Schrödinger Equation

D. Nguemalieu. Kouetcha [1], H. Ramezani [1][2], N. Cohaut [1],
[1] Université d’ Orléans, ICMN, UMR CNRS, Orléans France
[2] Ecole Polytechnique de l' Université d’ Orléans, Orléans, France

The accurate atomic potential determination is an essential task in the molecular simulations, e.g. Grand Canonical Monte Carlo (GCMC). The ab initio simulations using the quantum mechanics would of great interest in the computational physical chemistry. The numerical simulation of the adsorption phenomenon requires knowing the interactions parameters between the atoms that make up the systems ...

Claus Process Reactor Simulation

J. Plawsky[1],
[1]Rensselaer Polytechnic Institute, Troy, NY, USA

A model was developed to simulate the reaction, concentration field, flow field, and temperature distribution inside a Claus reactor for converting hydrogen sulfide to sulfur. The model considered two ideal reactors, a continuous stirred tank reactor and a plug flow reactor. As expected, two ideal reactors showed much different behaviors in terms of reactant conversion and operating ...

Charge-Discharge Studies of Lithium Iron Phosphate Batteries

A. K. R. Paul [1], R. D. Pal [2],
[1] CSIR-Central Electrochemical Research Institute, Karaikudi, Tamil Nadu, India
[2] Academy of Scientific and Innovative Research, Chennai, Tamil Nadu, India

A lithium-ion battery comprises of two intercalating electrodes separated by a membrane, sandwiched between aluminum and copper current collecting plates. The battery performance depends upon several parameters and its operating conditions. In this work we developed a model for a lithium iron phosphate battery and validated our results with experimental charge-discharge curves. We however note ...

Kinetics and Reactor Modeling of Methanol Synthesis from Synthesis Gas

H. Bakhtiary, F. Hayer, H. Venvik, A. Holmen
Norwegian University of Science and Technology Trondheim

Methanol synthesis is a typical reaction in heterogeneous catalysis. In this work, we have studied a laboratory fixed-bed reactor packed with a Cu/Zn/Al2O3 catalyst in both adiabatic and isothermal tubular operational modes. A methanol synthesis kinetic model was implemented in COMSOL Reaction Engineering Lab. Both 1D and 2D pseudo-homogeneous dispersion models were applied to describe the mass ...

Comparison of Diffusion Flux Models for Fischer-Tropsch Synthesis

A. Nanduri [1], P. L. Mills [1],
[1] Department of Chemical and Natural Gas Engineering, Texas A&M University - Kingsville, Kingsville, TX, USA

The Fischer-Tropsch Synthesis (FTS) is a highly exothermic condensation polymerization reaction of syngas (CO+H2) in the presence of Fe/Co/Ru-based catalysts to produce a wide range of paraffins, olefins and oxygenates, the latter of which is often called syncrude. Multi-Tubular Fixed Bed Reactors (MTFBR) and Slurry Bubble Column reactors (SBCR) are widely employed for FTS processes [1]. To ...