600 Poster Session of Catalysis and Reaction Engineering (CRE) Division

Wednesday, October 31, 2012: 6:00 PM
Hall B (Convention Center )
Description:
This is the Poster Session of CRE Division. All papers in catalysis and reaction engineering are invited. An award is given annually to the best paper in each of the catalysis and reaction engineering areas (see the CRE web site for details).

Sponsor:
Catalysis and Reaction Engineering Division

Chair:
John R. Kitchin
Email: jkitchin@andrew.cmu.edu

Co-Chair:
David D. Hibbitts
Email: ddh9r@virginia.edu

- indicates paper has an Extended Abstract file available on CD.


(600a) Hydrogenation of Succinic Acid Using Ruthenium Nanoparticles Embedded Catalysts
Sang-Ho Chung, Hee-Jun Eom, Min-Sung Kim and Kwan-Young Lee

(600aa) Computing Profiles of Porosity in a Packed Bed Using Monte Carlo Method
Genong Li

(600ab) Non-Carbon Electrocatalyst Supports for PEM Fuel Cells
Ying Liu and William E. Mustain

(600ac) Evaluating the Contribution of Direct Vs. Indirect Carbonate Production in Anion Exchange Membrane Fuel Cells
William E. Mustain, Michael Ignatowich, Gregory Crettol and Molly Chhiv

(600ad) EXAFS Analysis of Supported Ag for Liquid-Phase Logistics Fuel Desulfurization
John Heinzel, Azzam Mansour, Ronald Quinlan and Bruce Tatarchuk
File available
(600ae) Application of Differential Scanning Calorimetry and Mathematical Modeling for the Development of ESTER Phosphate Coatings
Charles F. Tillie, Shreya Adhikari, Andrew R. Snell and Jorge E. Gatica
File available
(600af) Catalytic Cracking of C5 Raffinates Over Modified ZSM-5 Zeolite
Min Hye Youn, Mi Jin Kim, Se Ho Park and Bo-Guen Song

(600ag) Assays for Enzymes Used in the Chemoenzymatic Synthesis of Heparin
Priscilla Paul, Jonathan Sheng, Robert J. Linhardt, Jonathan Dordick and Jian Liu

(600ah) Influence of Particle Size and Microstructure On the Oxidation Behavior of Carbon Blacks and Diesel Soot
Lakshitha Pahalagedara, Hom Sharma, Chung-Hao Kuo, Saminda Dharmarathna, Ameya Joshi, Steven Suib and Ashish B. Mhadeshwar

(600ai) Phase Transition of Ceria Using First Principles Calculations
Venkatesh Botu, Ashish B. Mhadeshwar and Ramamurthy Ramprasad

(600aj) QM/MM Metadynamics Analysis of Reaction Thermochemistry and Kinetics for Biomass Processing
Kelly Fleming and Jim Pfaendtner

(600ak) Effects of Sodium Substituted Solid Base ZrO2 On the Hydrogenolysis of Phenethyl Phenyl Ether (PPE) in near-Critical Water
Hee-Jun Eom, Yoon-Ki Hong, Sang-Ho Chung and Kwan-Young Lee

(600al) Hydrocracking of Vacuum Residue Using Activated Carbon and Metal Oxide in a Supercritical Solvent
Tran Tan Viet, Ma Fanzhong, Anton Koriakin, Jae Hyuk Lee, Doo Wook Kim and Chang-Ha Lee

(600am) Develop High Density SCR Catalyst for Marine Diesel Engine
Jai-Hyun Park, Joon Ho Ko and Hee Sung Yang
File available
(600an) Design and Evaluation of a Novel Carbon-Based Shape Selective Catalyst
Maryam Peer, Ali Qajar, Ramakrishnan Rajagopalan and Henry C. Foley

(600ao) Preliminary Test of Scrubber System for Marine Diesel Engines
Sung Young Lee and Hee Sung Yang

(600ap) Effect of Power Frequency On Non-Thermal Plasma Decomposition of Gaseous Pollutant
Soshi Watanabe, Kazuyoshi Yamamoto, Junichi Ida, Tatsushi Matsuyama and Hideo Yamamoto

(600ar) Employing Molecular Modifiers to Tailor the Crystal Morphology of Zeolite Catalysts
Alexandra I. Lupulescu and Jeffrey D. Rimer

(600as) Effects of Support Shape and Size On the Metal Distribution of Supported Catalysts
Xue Liu, Johannes G. Khinast and Benjamin J. Glasser

(600at) Application of Noble Catalytic System for Nitrate Removal in Wastewater
Min-Sung Kim, Sang-Ho Chung and Kwan-Young Lee

(600au) Supported Phosphide Catalysts for the Depolymerization of Lignin
Dallas J. Rensel and Jason C. Hicks

(600av) Biodiesel Production From Catalyzed Transesterification of Triolein Using Calcined Clay Mineral
Bing-Hung Chen and Tan Hiep Dang
File available
(600aw) Gas-Phase Oxidation of Hexafluoropropene with Molecular Oxygen: Reaction Chemistry and Kinetics
David Lokhat, Deresh Ramjugernath and Maciej Starzak

(600ax) Influence of Reaction Conditions On the Hydrolytic Cellulose Hydrogenation Using Ru/NbOPO4 and Ru/SiO2-TiO2-WO3 Catalysts
Darlene Z. Galloza-Lorenzo, José L. Contreras-Mora and Nelson Cardona-Martínez

(600ay) Theoretical Investigation of the Three-Phase Boundary of Ceria (111) Supported Platinum Clusters for the Water-Gas Shift Reaction
Sara Aranifard, Salai C. Ammal and Andreas Heyden

(600az) Revealing Cellulose Pyrolysis Chemistry
Alex D. Paulsen, Matthew S. Mettler, Dionisios G. Vlachos and Paul J. Dauenhauer

(600b) Characteristics of Pt-K/MgAl2O4 NOx Storage-Reduction Catalysts
Do Heui Kim, Kumudu Mudiyanselage, Janos Szanyi, Ja Hun Kwak and Charles H. F. Peden

(600ba) Effect of Power Frequency On Discharge Mode in a Non-Thermal Plasma Reactor for VOCs Decomposition
Teruhiko Kanemashi, Soshi Watanabe, Junichi Ida, Tatsushi Matsuyama and Hideo Yamamoto

(600bb) Catalytic Hydrodeoxygenation of Bio-Oil
Danni Gao, Hyun Tae Hwang and Arvind Varma

(600bc) Porous Microsphere Composites of Silver/Ceria/Titania for Solar Fuel Production
Daniel Pitts and Ying Li

(600bd) Catalytic Cycloaddition of Ethylene to Dimethylfuran for the Production of p-Xylene
Christopher L. Williams, Chun-Chih Chang, Phuong T. Do, Nima Nikbin, Stavros Caratzoulas, Dionisios G. Vlachos, Raul F. Lobo, Wei Fan and Paul J. Dauenhauer

(600be) Deoxygenation of Biofuel Model Compounds (Ethanol and 2-Methyltetrahydrofuran) On Silica Supported Nickel Phosphide
Phuong P. Bui, Dan Li and S. Ted Oyama

(600bf) Upgrading of Biomass-Derived Aromatics in Aqueous Phase
Jin Yang, Ashwin Ramasubramaniam and Paul J. Dauenhauer

(600bg) Enzyme-Inspired Sulfur Tolerant Iron Nanocatalysts
Debosruti Dutta, Vanessa A. Castillo, John N. Kuhn and Venkat R. Bhethanabotla

(600bh) A Comparative Study On Bubble Velocity in Mini Channels
Christine Meitzner, Erik Reichelt, Muthanna Al-Dahhan and Ruediger Lange

(600bi) Surface Barriers: Understanding Diffusion Limitations in MFI Structured Zeolites
Andrew R. Teixeira, Chun-Chih Chang, Wei Fan and Paul J. Dauenhauer

(600bj) Hydrogenation of α-Methylstyrene in a Mini Fixed-Bed Reactor Under External Mass Transfer Limitation
Robert Langsch, Stefan Haase and Ruediger Lange

(600bk) Mesopore Formation During Zeolite Dry Gel Syntheses: A FIB/SEM Study
Gregory T. Neumann and Jason C. Hicks

(600bl) Bayesian Methods in Multiscale Modeling
David S. Mebane, K. Sham Bhat, Joel D. Kress, David C. Miller, Juan E. Morinelly and John Eslick

(600bm) Hydrodynamics of Trickle-Bed Reactors with Particle Size Distributions
Gregory S. Honda, Wesley Fleming, Philip Gase and Arvind Varma

(600bn) Novel Ferrite Materials for Efficient H2 Production and CO2 Separation Using Chemical Looping Hydrogen Production
Victoria J. Aston, Brian W. Evanko, Jonathan Scheffe and Alan W. Weimer

(600bo) Homogeneous Esterification of Isoamyl Alcohol with Salycilic ACID, Kinetic Study
Yurany P. Jiménez, Yohana Paez, Alvaro Orjuela and Gerardo Rodriguez

(600bp) Oxidative Coupling of Methane Using Solution Combustion Synthesized Catalytic Materials
Ranjita Ghose, Hyun Tae Hwang and Arvind Varma

(600bq) Computational Study On Olefin Metathesis of Ethene and 2-Butene On WO3 Surfaces
Zhuo Cheng and Cynthia S. Lo

(600br) Direct Propylene Epoxidation with Molecular Oxygen On Optically Active Copper Catalyst
Marimuthu Andiappan and Suljo Linic

(600bu) Systematic Analysis and Prediction of Steady State Multiplicity Patterns
Satish J. Parulekar and Swapnil Hegishte

(600bv) New Pathways for Formation of Acids and Carbonyl Compounds in Low Temperature Oxidation
Amrit Jalan, Ionut M. Alecu, Jorge Aguilera-Iparraguirre, Shamel S. Merchant and William H. Green Jr.

(600bw) Conversion of Fructose to 5-Hydroxymethylfurfural in Aqueous/Organic Media Using Formic Acid As Catalyst
Nan Jiang, Renliang Huang, Wei Qi, Rongxin Su and Zhimin He

(600bx) The Effect of Rare Earth On the Structure and Performance of Pd/Cordierite Monolithic Catalyst
Shengfu Ji
File available
(600­by) Preparation and Characterization of Modified Cu-ZnO-Al2O3 Catalysts for Methanol Synthesis
Dong-Ju Moon, Kannapu Hari Prasad Reddy, Tae Woon Kwon, Subin Lee, Jae-sun Jung, Jae-suk Lee, Hyun Jin Kim, Byoung Sung Ahn and Sang Woo Kim
File available
(600bz) Studies On FTS Reaction Over Modified Co/Al2O3 Catalyst for Gtl-FPSO Process
Dong-Ju Moon, Jae-sun Jung, Jae-suk Lee, Tae Woon Kwon, Jin Hee Lee, Hyun Jin Kim, Jong Wook Bae and Kun Woong Oh

(600c) Reduction of Precious Metal Loading in LNT-SCR Dual-Layer Monolithic Catalyst: Using H2 and CO As Reductants
Yi Liu, Dan Luss and Michael Harold

(600ca) A Density Functional Theory Study of Methanol Steam Reforming Catalyzed by Cobalt Based Materials
Wenjia Luo and Aravind Asthagiri

(600cb) A DFT Study for the Catalytic Oxidation of Terminal Alkenes
Kanika Mittal and Linda J. Broadbelt
File available
(600cc) A Review of the Various Catalysts Used for Biomass Gasification in Industry and a Proposed Alternative Solution
Leesha Blake and Sunggyu Lee

(600cd) CO2 Photoreduction Key Step Study: The Adsorption of CO2 On TiO2 Surfaces in the Presence of Co-Catalyst
Chi-Ta Yang, Nianthrini Balakrishnan, Babu Joseph and Venkat Bhethanabotla

(600cf) Conversion of HMF and Furfuryl Alcohol to Levulinic Acid Using a Hierarchical Material As Catalyst
Christian G. Rivera-Goyco

(600cg) Effect of Supercritical Hexanes Reaction Medium and H2/CO Molar Ratio On the Synthesis of Higher Alcohols From Syngas Over a K-Promoted Cu-Co-Zn Catalyst
Charlotte Stewart, Rui Xu, Sihe Zhang, David Roe and Christopher B. Roberts

(600ch) Establishing the Connection Between the Geometric and Electronic Structure of Oxygen Species On Stepped Ag Surfaces: First-Principles DFT and Monte Carlo Studies
Matthew Morabito, Hongliang Xin and Suljo Linic

(600ci) Furfural Production From Microwave Catalytic Torrefaction of Douglas Fir Sawdust Pellets
Shoujie Ren, Hanwu Lei, Lu Wang, Quan Bu, Yupeng Liu, Jing Liang, Yi Wei, Shulin Chen, Joan Wu and Roger Ruan

(600cj) Investigation of Ag Diammine Impregnation On Low/High PZC Oxides and Carbon Using Strong Electrostatic Adsorption
Eleni A. Kyriakidou, Oleg S. Alexeev, John R. Regalbuto and Michael D. Amiridis

(600ck) Kinetic Studies of Composite Plasmonic-Metal/Semiconductor Photocatalysts for Water Splitting
Michelle Przybylek and Suljo Linic

(600cl) Microwave-Assisted Synthesis of Silico-Alumino-Phosphate SAPO-56
Zhenzhen Xie

(600cm) One Pot Synthesis of Hydroxy Methy Furfural From Cellulose in Organic Electrolyte Solution Systems
Siamak Alipour, Sridhar Viamajala and Sasidhar Varanasi

(600cn) Production of Middle Distillate Range Liquid Fuels From Syngas Using Fischer-Tropsch Synthesis and Associated Upgrading Technology Under Supercritical Phase Conditions and Multiple Reactor Configurations
David Roe, Sihe Zhang, Rui Xu, Charlotte Stewart, J. Ed Durham and Christopher B. Roberts

(600co) Similarities and Differences Between NHC- and Pincer Nickel Complex-Catalyzed CO2 Transformations Into Methanol: Mechanistic Insight From DFT Calculations
Zhixiang Wang

(600cp) The Influence of Surface Roughness in SBA-15 and Zirconium Substitution On Methanol Oxidation
Benaiah Anabaraonye and Michael A. Smith

(600cq) The Intensification of Mass Transfer of CO2 Bubble Absorption Into Monoethanol Amine (MEA) Aqueous Solution in a Rectangular Microchannel
Xiqun Gao, Chunfang LI, Taotao Fu and Youguang Ma

(600cs) The Role of Pt On the Photoactivity of TiO2
Christopher Lawrence Muhich, Yun Zhou, Aaron Holder, Alan W. Weimer and Charles Bruce Musgrave
File available
(600ct) Thermodynamical Analysis of Glycerol Partial Oxidation Reaction Using Zeolites Catalyst
Gabriel Camargo, Stephany Cardozo and Mauricio V Peña
File available
(600cu) Zeolitic Imidazole Framework-8 Catalysts in the Conversion of CO2 to Chloropropene Carbonate
Minqi Zhu

(600d) Amorphous-to-Crystalline Transformation of Pt Nanoparticles: Dependency On Size, Support and Adsorbates
Long Li, Lin-Lin Wang, Duane D. Johnson, Zhongfan Zhang, Sergio Sanchez, Joo H. Kang, Ralph G. Nuzzo, Qi Wang, Anatoly I. Frenkel, James Ciston, Eric A. Stach, Jie Li and Judith C. Yang

(600e) Reaction Dynamics of Alkene Methylation in H-MFI
Joseph S. Gomes, Martin Head-Gordon and Alexis T. Bell

(600f) Impact of Drop to Idle On a Particulate Diesel Filter Fed by a Cone
Mengting Yu and Dan Luss

(600g) Influence of Pt Dispersion On NO Oxidation for the Modeling of Lean NOx Trap Catalyst Degredation
Travis Wentworth, Susan Williams, Christopher D. Depcik and Loya Sudarshan
File available
(600h) Surface Chemistry Studies of the Reaction of CO2 with MgO(100) and TiO2(100)
Juan Wang, C Michael Greenlief and Tom R. Marrero

(600i) Modeling and Kinetic Parameter Estimation of Ethylene Polymerization with Silica Supported Dimethylsilylene Bis(η5 –inden-1–ylidene)Zirconium Dichloride Catalyst Using Differential Evolution Approach
Nikhil Prakash, Sushil Kumar and Arvind Kumar Sharma
File available
(600j) Effect of Operating Conditions On Selectivity of Propylene From Bio-Ethanol Dehydration Using SAPO-34 Catalyst
Apirat Chaitanarit, Chatapong Wungtanagorn and Sirirat Jitkarnka
File available
(600k) Hexane Cracking Over H-ZSM-5 with Different Al Contents
Hiroshi Mochizuki, Toshiyuki Yokoi, Seitaro Namba, Junko N. Kondo and Takashi Tatsumi
File available
(600l) The Industrial Application of the Catalyst for Removal the Trace Olefin From Aromatics
Xin Pu and Li Shi

(600m) Comparative Analysis of the Structure and Chemical Nature of Carbon Blacks and Diesel Soot
Lakshitha Pahalagedara, Saminda Dharmarathna, Chung-Hao Kuo, Hom Sharma, Ameya Joshi, Steven Suib and Ashish B. Mhadeshwar

(600n) Fundamental Understanding of Lignin Deconstruction – Quantum Chemical Investigation and Microkinetic Modeling of Prevalent Reactions
Satyender Goel, Abraham Yanez-McKay, Vinu Ravikrishnan and Linda J. Broadbelt

(600o) Diffusion of n-Hexane in Mesoporous Ceria-Zirconia-Yttria Catalyst Supports
Alma I. Morales and David A. Bruce

(600p) Comparative Study of Direct Methanol Fuel Cell Anode Catalysts
Wei Cheng, Luke M. Neal and H. H. Weaver
File available
(600q) Methane Combustion Over MnOx-Based Catalysts At Low Temperatures : Operando Raman and Kinetic Study
Yi-Fan Han

(600r) A Novel Bimetallic Catalyst for the Oxidative Esterification of Aldehyde
Bao H Wang, Wen J Sun and Jing Zhu
File available
(600s) Heck Coupling with Sol-Gel Immobilized Palladium Catalysts
Iryna Volovych, Prof. Dr. Reinhard Schomäcker and Prof. Dr. Jochanan Blum

(600t) Biomimetic Synthesis of Magnetic Composite Particles for Laccase Immobilization
XiaoBing Zheng, Yanjun Jiang and Jing Gao

(600u) The Effect of Rare Earth On the Structure and Performance of Pd/Cordierite Monolithic Catalysts
Shengfu Ji

(600v) Thermodynamic and Kinetic Modeling of the SILP Reaction for the Hydrogenation of Propene, the Water Gas Shift Reaction and the Hydroformylation of 1-Butene
Johannes Hartmann, Alexander Buchele, Wolfgang Arlt, Sebastian Werner, Andreas Schoenweiz and Peter Wasserscheid

(600w) Ethane Oxidative Dehydrogenation Over Vox/Al2O3 Catalyst in a Fluidized Bed Reactor Under Oxygen-Free Conditions
Sameer A. Al-Ghamdi, Hugo H. De Lasa, Maria Volpe and Mohammad M. Hossain
File available
(600y) Bamboo-Shaped Carbon Nanotubes and Hydrogen Produced by Catalytic Decomposition of Methane Over Ni-Cu-Zn Supported On MCM-22 Catalyst
Sushil kumar Saraswat and K. K. Pant

(600z) Thermal Decomposition of K-Comosx Catalyst Precursors: Effects On Catalyst Morphology and Performance
Jesse E. Hensley, Martin Menart and Kellen Costelow
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