Engineering Commons^™

High Capacity Silicon Electrodes With Nafion As Binders For Lithium-Ion Batteries, Jiagang Xu, Qinglin Zhang, Yang-Tse Cheng

Chemical and Materials Engineering Faculty Publications

Silicon is capable of delivering a high theoretical specific capacity of 3579 mAh g⁻¹ which is about 10 times higher than that of the state-of-the-art graphite based negative electrodes for lithium-ion batteries. However, the poor cycle life of silicon electrodes, caused by the large volumetric strain during cycling, limits the commercialization of silicon electrodes. As one of the essential components, the polymeric binder is critical to the performance and durability of lithium-ion batteries as it keeps the integrity of electrodes, maintains conductive path and must be stable in the electrolyte. In this work, we demonstrate that electrodes consisting of …

Strategies For The Production Of Cell Wall-Deconstructing Enzymes In Lignocellulosic Biomass And Their Utilization For Biofuel Production, Sang-Hyuck Park, Rebecca Garlock Ong, Mariam Sticklen

Department of Chemical Engineering Publications

Microbial cell wall-deconstructing enzymes are widely used in the food, wine, pulp and paper, textile, and detergent industries and will be heavily utilized by cellulosic biorefineries in the production of fuels and chemicals. Due to their ability to use freely available solar energy, genetically engineered bioenergy crops provide an attractive alternative to microbial bioreactors for the production of cell wall-deconstructing enzymes. This review article summarizes the efforts made within the last decade on the production of cell wall-deconstructing enzymes in planta for use in the deconstruction of lignocellulosic biomass. A number of strategies have been employed to increase enzyme yields …

Modeling Of Gas Production From Shale Reservoirs Considering Multiple Transport Mechanisms, Chaohua Guo, Mingzhen Wei, Hong Liu

Geosciences and Geological and Petroleum Engineering Faculty Research & Creative Works

Gas transport in unconventional shale strata is a multi-mechanism-coupling process that is different from the process observed in conventional reservoirs. In micro fractures which are inborn or induced by hydraulic stimulation, viscous flow dominates. And gas surface diffusion and gas desorption should be further considered in organic nano pores. Also, the Klinkenberg effect should be considered when dealing with the gas transport problem. In addition, following two factors can play significant roles under certain circumstances but have not received enough attention in previous models. During pressure depletion, gas viscosity will change with Knudsen number; and pore radius will increase when …

Sustainability Assessment For Energy Systems And Chemical Process Industries, Michael J. Matzen

Department of Chemical and Biomolecular Engineering: Theses and Student Research

Sustainability has become an important factor in the chemical process and energy industries with a strong drive for process improvements towards more environmentally conscious solutions. However, there are many ways of defining sustainability and even more ways of trying to determine how sustainable a process is. This work looks into applying a conjunction of tools including; process simulation, multi-criteria decision matrices and life-cycle assessment to more quantitatively determine sustainability metrics. We have applied these tools for the production of electricity, methanol and dimethyl ether. A novel method of electricity production, in chemical looping combustion (CLC), was used that inherently involves …

Size-Controlled Large-Diameter And Few-Walled Carbon Nanotube Catalysts For Oxygen Reduction, Xianliang Wang, Qing Li, Hengyu Pan, Ye Lin, Yujie Ke, Haiyang Sheng, Mark T. Swihart, Gang Wu

Faculty Publications

We demonstrate a new strategy for tuning the size of large-diameter and few-walled nitrogen-doped carbon nanotubes (N-CNTs) from 50 to 150 nm by varying the transition metal (TM = Fe, Co, Ni or Mn) used to catalyze graphitization of dicyandiamide. Fe yielded the largest tubes, followed by Co and Ni, while Mn produced a clot-like carbon morphology. We show that morphology is correlated with electrocatalytic activity for the oxygen reduction reaction (ORR). A clear trend of Fe > Co > Ni > Mn for the ORR catalytic activity was observed, in both alkaline media and more demanding acidic media. The Fe-derived N-CNTs exhibited …

Overview Of Estimation Methods For Industrial Dynamic Systems, John Hedengren, Ammon Eaton

Faculty Publications

Measurement technology is advancing in the oil and gas industry. Factors such as wireless transmitters, reduced cost of measurement technology, and increased regulations that require active monitoring tend to increase the number of available measurements. There is a clear opportunity to distill the recent flood of measurements into relevant and actionable information. Common methods to do this include a filtered bias update, implicit dynamic feedback, Kalman filtering, and moving horizon estimation. The purpose of these techniques is to validate measurements and align imperfect mathematical models to the actual process. Additionally, they can determine a best-estimate of the current state of …

Chemical Processing Cell With Nanostructured Membranes, Dibakar Bhattacharyya, Scott R. Lewis, Saurav Datta

Chemical and Materials Engineering Faculty Patents

A chemical processing cell includes an upstream membrane and a downstream membrane. The upstream membrane generates a first reaction product. The downstream membrane converts the first reaction product to a second reaction product.

Prediction And Validation Of External Cooling Loop Cryogenic Carbon Capture (Ccc-Ecl) For Full-Scale Coal-Fired Power Plant Retrofit, Mark J. Jensen, Christopher S. Russell, David Bergerson, Christopher D. Hoeger, David J. Frankman, Christopher S. Bence, Larry Lin Baxter

Faculty Publications

Bench-scale experiments and Aspen Plus (TM) simulations document full-scale, steady-state performance of the external cooling loop cryogenic carbon capture (CCC-ECL) process for a 550 MWe coal-fired power plant. The baseline CCC-ECL process achieves 90% CO2 capture, and has the potential to capture 99+ % of CO2, SO2, PM, NO2, Hg, and most other noxious species. The CCC-ECL process cools power plant flue gas to 175 K, at which point solid CO2 particles desublimate as the flue gas further cools to 154K. Desublimating flue gas cools in a staged column in direct contact with a cryogenic liquid and produces a CO2-lean …

Electrode Kinetics Of Vanadium Flow Batteries: Contrasting Responses Of VIi-VIii And VIv-VV To Electrochemical Pretreatment Of Carbon, A. Bourke, M. A. Miller, R. P. Lynch, Xin Gao, James Landon, J. S. Wainright, R. F. Savinell, D. N. Buckley

Center for Applied Energy Research Faculty and Staff Publications

Electrochemical impedance spectroscopy and cyclic voltammetry were used to investigate the electrode kinetics of V^II-V^III and V^IV-V^V in H₂SO₄ on glassy carbon, carbon paper, carbon xerogel, and carbon fibers. It was shown that, for all carbon materials investigated, the kinetics of V^II-V^III is enhanced by anodic, and inhibited by cathodic, treatment of the electrode; in contrast, the kinetics of V^IV-V^V is inhibited by anodic, and enhanced by cathodic, treatment. The potential region for each of these effects varied only slightly with carbon material. Rate constants …

High Temperature Proton Exchange Membranes With Enhanced Proton Conductivities At Low Humidity And High Temperature Based On Polymer Blends And Block Copolymers Of Poly(1,3-Cyclohexadiene) And Poly(Ethylene Glycol), Shawn Deng, Mohammad K. Hassan, Amol Nalawade, Kelly A. Perry, Karren L. More, Kenneth A. Mauritz, Marshall T. Mcdonnell, David J. Keffer, Jimmy W. Mays

Faculty Publications

Hot (at 120 °C) and dry (20% relative humidity) operating conditions benefit fuel cell designs based on proton exchange membranes (PEMs) and hydrogen due to simplified system design and increasing tolerance to fuel impurities. Presented are preparation, partial characterization, and multi-scale modeling of such PEMs based on cross-linked, sulfonated poly(1,3-cyclohexadiene) (xsPCHD) blends and block copolymers with poly(ethylene glycol) (PEG). These low cost materials have proton conductivities 18 times that of current industry standard Nafion at hot, dry operating conditions. Among the membranes studied, the blend xsPCHD-PEG PEM displayed the highest proton conductivity, which exhibits a morphology with higher connectivity of …

Application Of A Coated Film Catalyst Layer Model To A High Temperature Polymer Electrolyte Membrane Fuel Cell With Low Catalyst Loading Produced By Reactive Spray Deposition Technology, Timothy D. Myles, Siwon Kim, Radenka Maric, William E. Mustain

Faculty Publications

In this study, a semi-empirical model is presented that correlates to previously obtained experimental overpotential data for a high temperature polymer electrolyte membrane fuel cell (HT-PEMFC). The goal is to reinforce the understanding of the performance of the cell from a modeling perspective. The HT-PEMFC membrane electrode assemblies (MEAs) were constructed utilizing an 85 wt. % phosphoric acid doped Advent TPS® membranes for the electrolyte and gas diffusion electrodes (GDEs) manufactured by Reactive Spray Deposition Technology (RSDT). MEAs with varying ratios of PTFE binder to carbon support material (I/C ratio) were manufactured and their performance at various operating temperatures was …

Highly Selective Hydrogenation And Hydrogenolysis Using A Copper-Doped Porous Metal Oxide Catalyst, Laurene Petitjean, Raphael Gagne, Evan Beach, Dequan Xiao, Paul Anastas

Chemistry and Chemical Engineering Faculty Publications

A copper-doped porous metal oxide catalyst in combination with hydrogen shows selective and quantitative hydrogenolysis of benzyl ketones and aldehydes, and hydrogenation of alkenes. The approach provides an alternative to noble-metal catalysed reductions and stoichiometric Wolff-Kishner and Clemmensen methods.

Label-Free Surface-Enhanced Raman Spectroscopy-Linked Immunosensor Assay (Slisa) For Environmental Surveillance, Vinay Bhardwaj

FIU Electronic Theses and Dissertations

The contamination of the environment, accidental or intentional, in particular with chemical toxins such as industrial chemicals and chemical warfare agents has increased public fear. There is a critical requirement for the continuous detection of toxins present at very low levels in the environment. Indeed, some ultra-sensitive analytical techniques already exist, for example chromatography and mass spectroscopy, which are approved by the US Environmental Protection Agency for the detection of toxins. However, these techniques are limited to the detection of known toxins. Cellular expression of genomic and proteomic biomarkers in response to toxins allows monitoring of known as well as …

Gasification Of Coal And Heat Integration Modification For Igcc - Integrated Gasification Combined Cycle, Dalia A. Ali Eng, Mamdouh A. Gadalla Prof., Fatma H. Ashour Prof.

Chemical Engineering

Use of energy is closely related to the development of an economy. The most useful form of energy in the modern world is electricity. IGCC has higher fuel flexibility (biomass, refinery residues, petroleum coke, etc.) and generates multiple products (electricity, hydrogen and chemicals like methanol and higher alcohols) and by-products - sulphur, sulphuric acid, slag, etc. IGCC plants include coal preparation unit, air separation unit (ASU) to separate oxygen from air to use it in the gasification process, gasification unit where an incomplete combustion for coal is made to produce Syngas, cleaning unit to remove acid gases and CO2 from …

Influence Of Carbon Nanofillers On The Curing Kinetics Of Epoxy-Amine Resin, Luigi Vertuccio, Salvatore Russo, Marialuigia Raimondo, Khalid Lafdi, Liberata Guadagno

Chemical and Materials Engineering Faculty Publications

The cure kinetics of an epoxy resin based on the tetrafunctional epoxy precursor N,N′-tetraglycidyl methylene dianiline-(TGMDA) hardened with 4,4-diaminodiphenyl sulfone is investigated. The influence of carbon nanofillers (carbon nanotubes, carbon nanofibers, and graphene based nanoparticles) on the cure kinetic is studied. Kinetic analysis is performed by dynamic and isothermal differential scanning calorimetry (DSC).

In dynamic experiments, the activation energy was computed using an advanced isoconversional method while under isothermal conditions, the Kamal’s model of diffusion control was applied to simulate the systems throughout the curing process. The isothermal analysis shows that the introduction of the diluent decreases, …

A Framework For An Economic Model Of Novel Process For The Fractionation Of Dried Distillers Grain With Solubles, R. Zakrzewski, K. Gounaropoulos, R. Allmendinger, M. Villegas Torres, C. Ibenegbu, R. Roque, S. Farid, J. Ward, G. Lye

Biorefinery I: Chemicals and Materials From Thermo-Chemical Biomass Conversion and Related Processes

No abstract provided.

Conference Program And Abstracts, Nicolas Abatzoglou, Sascha Kersten, Dietrich Meier

Biorefinery I: Chemicals and Materials From Thermo-Chemical Biomass Conversion and Related Processes

No abstract provided.

Hybrid Dynamic Optimization Methods For Systems Biology With Efficient Sensitivities, Nicholas Lewis, John Hedengren, Eric Haseltine

Faculty Publications

In recent years, model optimization in the field of computational biology has become a prominent area for development of pharmaceutical drugs. The increased amount of experimental data leads to the increase in complexity of proposed models. With increased complexity comes a necessity for computational algorithms that are able to handle the large datasets that are used to fit model parameters. In this study the ability of simultaneous, hybrid simultaneous, and sequential algorithms are tested on two models representative of computational systems biology. The first case models the cells affected by a virus in a population and serves as a benchmark …

Structural And Functional Characterization Of A Lytic Polysaccharide Monooxygenase With Broad Substrate Specificity, Anna S. Borisova, Trine Isaksen, Maria Dimarogona, Abhishek A. Kognole, Geir Mathiesen, Anikó Várnai, Åsmund K. Røhr, Christina M. Payne, Morten Sørlie, Mats Sandgren, Vincent G. H. Eijsink

Chemical and Materials Engineering Faculty Publications

The recently discovered lytic polysaccharide monooxygenases (LPMOs) carry out oxidative cleavage of polysaccharides and are of major importance for efficient processing of biomass. NcLPMO9C from Neurospora crassa acts both on cellulose and on non-cellulose β-glucans, including cellodextrins and xyloglucan. The crystal structure of the catalytic domain of NcLPMO9C revealed an extended, highly polar substrate-binding surface well suited to interact with a variety of sugar substrates. The ability of NcLPMO9C to act on soluble substrates was exploited to study enzyme-substrate interactions. EPR studies demonstrated that the Cu²⁺ center environment is altered upon substrate binding, whereas isothermal titration …

Nickel Extraction From Olivine: Effect Of Carbonation Pre-Treatment, Rafael M. Santos, Aldo Van Audenaerde, Yi Wai Chiang, Remus I. Iacobescu, Pol Knops, Tom Van Gerven

Faculty Publications and Scholarship

In this work, we explore a novel mineral processing approach using carbon dioxide to promote mineral alterations that lead to improved extractability of nickel from olivine ((Mg,Fe)2SiO4). The precept is that by altering the morphology and the mineralogy of the ore via mineral carbonation, the comminution requirements and the acid consumption during hydrometallurgical processing can be reduced. Furthermore, carbonation pre-treatment can lead to mineral liberation and concentration of metals in physically separable phases. In a first processing step, olivine is fully carbonated at high CO2 partial pressures (35 bar) and optimal temperature (200 °C) with the addition of pH buffering …

Local Time-Averaged Gas Holdup In Fluidized Bed Reactor Using Gamma Ray Computed Tomography Technique (Ct), Abdelsalam Efhaima, Muthanna H. Al-Dahhan

Chemical and Biochemical Engineering Faculty Research & Creative Works

Many Invasive and Non-Invasive Techniques Have Been Used to Analyze the Hydrodynamics of Fluidized Beds. in This Study, the Effect of Superficial Gas Velocity and Bed Particle Density on the Hydrodynamics of Gas–solid Fluidized Beds Was Investigated by using a Cylindrical Plexiglas Fluidized Bed Column, 14 Cm in Diameter. Air at Room Temperature Was Used as the Fluidizing Gas and Two Different Geldart Type-B Particles Were Used: Glass Beads and Copper Particles with Material Densities of 2.5 and 5.3 G/cm3, Respectively, with the Same Size Particle, 210 µm. to Measure the Time-Averaged Cross-Sectional Gas and Solid Holdup Distribution, Gamma Ray …

The Role Of Biological Fluid And Dynamic Flow In The Behavior And Cellular Interactions Of Gold Nanoparticles, Emily K. Breitner, Saber M. Hussain, Kristen K. Comfort

Chemical and Materials Engineering Faculty Publications

Background: Due to their distinctive physicochemical properties, nanoparticles (NPs) have proven to be extremely advantageous for product and application development, but are also capable of inducing detrimental outcomes in biological systems. Standard in vitro methodologies are currently the primary means for evaluating NP safety, as vast quantities of particles exist that require appraisal. However, cell-based models are plagued by the fact that they are not representative of complex physiological systems. The need for a more accurate exposure model is highlighted by the fact that NP behavior and subsequent bioresponses are highly dependent upon their surroundings. Therefore, standard in vitro models …

Characterization Of Iron Phthalocyanine As The Cathode Active Material For Lithium-Ion Batteries, Sarwan S. Sandhu, Joseph P. Fellner

Chemical and Materials Engineering Faculty Publications

The developed thermodynamic functions for the determination of Gibbs free energy, enthalpy, and entropy of formation of solid lithium-iron phthalocyanine (LixFePc) from solid lithium and iron phthalocyanine as a function of x, defined as g-moles of the intercalated lithium per g-mole of iron phthalocyanine, at a fixed set of temperature and pressure conditions are presented. In addition, a proposed expression for the evaluation of lithium diffusion coefficient in solid iron phthalocyanine as a function of both x and temperature, and the experimental results from the ongoing research/development work on the lithium/iron phthalocyanine cells are included.

Raman Spectroscopy Applied To The Noninvasive Detection Of Monosodium Urate Crystal Deposits, Declan J. Curran, Laurence Rubin, Mark R. Towler

Chemical and Biochemical Engineering Faculty Research & Creative Works

An off-the-shelf Raman Spectrometer (RS) was used to noninvasively determine the presence of monosodium urate (MSU) crystals on the metatarsophalangeal joint (MTPJ) of a single gout sufferer. The spectrum sourced from the clinically diagnosed gout sufferer was compared to that sourced from an age-matched healthy subject scanned using the same protocol. Minimal signal processing was conducted on both spectra. Peaks characteristic of MSU crystals were evident on the spectrum sourced from the gout sufferer and not on the spectrum from the healthy control.

Silver Nanoparticle Coated Bioactive Glasses - Composites With Dex/Cmc Hydrogels: Characterization, Solubility, And In Vitro Biological Studies, Anthony W. Wren, Pegah Hassanzadeh, Lana M. Placek, Timothy J. Keenan, Aisling Coughlan, Lydia R. Boutelle, Mark R. Towler

Chemical and Biochemical Engineering Faculty Research & Creative Works

Silver (Ag) coated bioactive glass particles (Ag-BG) were formulated and compared to uncoated controls (BG) in relation to glass characterization, solubility and microbiology. X-ray diffraction (XRD) confirmed a crystalline AgNP surface coating while ion release studies determined low Ag release (/L). Cell culture studies presented increased cell viability (127 and 102%) with lower liquid extract (50 and 100 ml/ml) concentrations. Antibacterial testing of Ag-BG in E. coli, S. epidermidis and S. aureus significantly reduced bacterial cell viability by 60-90%. Composites of Ag-BG/CMC-Dex Hydrogels were formulated and characterized. Agar diffusion testing was conducted where Ag-BG/hydrogel composites produced the largest inhibition zones …

System And Process For Upgrading Hydrocarbons, Dennis N. Bingham, Kerry M. Klingler, Joseph D. Smith, Terry D. Turner, Bruce M. Wilding

Chemical and Biochemical Engineering Faculty Research & Creative Works

In one embodiment, a system for upgrading a hydrocarbon material may include a black wax upgrade subsystem and a molten salt gasification (MSG) subsystem. The black wax upgrade subsystem and the MSG subsystem may be located within a common pressure boundary, such as within a pressure vessel. Gaseous materials produced by the MSG subsystem may be used in the process carried out within the black wax upgrade subsystem. For example, hydrogen may pass through a gaseous transfer interface to interact with black wax feed material to hydrogenate such material during a cracking process. In one embodiment, the gaseous transfer interface …

Bioactive Glass Reinforced Elastomer Composites For Skeletal Regeneration: A Review, Ehsan Zeimaran, Sara Pourshahrestani, Ivan Djordjevic, Belinda Pingguan-Murphy, Nahrizul Adib Kadri, Mark R. Towler

Chemical and Biochemical Engineering Faculty Research & Creative Works

Biodegradable elastomers have clinical applicability due to their biocompatibility, tunable degradation and elasticity. The addition of bioactive glasses to these elastomers can impart mechanical properties sufficient for hard tissue replacement. Hence, a composite with a biodegradable polymer matrix and a bio glass filler can offer a method of augmenting existing tissue. This article reviews the applications of such composites for skeletal augmentation.

Hydrocarbon-Based Fuel Cell Membranes: Sulfonated Crosslinked Poly(1,3-Cyclohexadiene) Membranes For High Temperature Polymer Electrolyte Fuel Cells, Suxiang Deng, Mohammad K. Hassan, Kenneth A. Mauritz, Jimmy W. Mays

Faculty Publications

High temperature fuel cell membranes based on poly(1,3-cyclohexadiene) were prepared by a Polymerization-Crosslinking-Sulfonation (PCS) approach, and a broad range of membrane compositions were achieved using various sulfonating reagents and reaction conditions. Membranes were characterized for their proton conductivity and thermal degradation behavior. Some of the membranes showed up to a 68% increase in proton conductivity as compared to Nafion under the same conditions (100% relative humidity and 120 °C). Thermogravimetric analysis revealed that these membranes are thermally stable up to 200 °C. High proton conductivity and thermal stability, combined with much lower cost as compared to Nafion®, make these materials …

Electrode Side Reactions, Capacity Loss And Mechanical Degradation In Lithium-Ion Batteries, Jiagang Xu, Rutooj D. Deshpande, Jie Pan, Yang-Tse Cheng, Vincent S. Battaglia

Chemical and Materials Engineering Faculty Publications

For advancing lithium-ion battery (LIB) technologies, a detailed understanding of battery degradation mechanisms is important. In this article, experimental observations are provided to elucidate the relation between side reactions, mechanical degradation, and capacity loss in LIBs. Graphite/Li(Ni_1/3Mn_1/3Co_1/3)O₂ cells of two very different initial anode/cathode capacity ratios (R, both R > 1) are assembled to investigate the electrochemical behavior. The initial charge capacity of the cathode is observed to be affected by the anode loading, indicating that the electrolyte reactions on the anode affect the electrolyte reactions on the cathode. Additionally, the rate of “marching” …

A Quantitative Perspective On Surface Marker Selection For The Isolation Of Functional Tumor Cells, Calvin F. Cahall, Jacob L. Lilly, Edward A. Hirschowitz, Brad J. Berron

Chemical and Materials Engineering Faculty Publications

Much effort has gone into developing fluid biopsies of patient peripheral blood for the monitoring of metastatic cancers. One common approach is to isolate and analyze tumor cells in the peripheral blood. Widespread clinical implementation of this approach has been hindered by the current choice of targeting epithelial markers known to be highly variable in primary tumor sites. Here, we review current antigen-based tumor cell isolation strategies and offer biological context for commonly studied cancer surface markers. Expression levels of the most common markers are quantitated for three breast cancer and two non-small cell lung cancer (NSCLC) lineage models. These …