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Energy & Fuels PreprintsPresented at the 246th ACS
National Meeting & Exhibition
2013
Division of Energy & Fuels, American Chemical Society
Energy & Fuels Preprints Volume 58 Number 2
Indianapolis, Indiana, USA
8-12 September 2013
Editors:
Hong Cui
ISBN: 978-1-62748-843-3
Table of Contents
2nd International Symposium on Graphene for Energy and Fuels
Tailored Assembly of Chemically Modifed Carbon Nanomaterials for Advanced 1
Optoelectronics and Energy Applications
Sang Ouk Kim
Chemically modifying graphene for surface functionality 3
Paul Sheehan, Rory Stine, Jeremy Robinson, Sandra Hernandez, Keith Whitener, Scott Walton
Hybrid graphene and single-walled carbon nanotubes material in supercapacitors, 4
field emitters and microsupercapacitors
James Tour
Graphene-Based Membrane and Porous Materials for Gas Separation 5
De-en Jiang
Electrodes for dye-sensitized solar cells: a case of graphene-based materials 6
Ladislav Kavan, Jun-Ho Yum, Michael Graetzel
From Graphitization to Graphenization 7
Weijie Lu
Tailoring and integrating graphene into device architectures via chemical 8
modification
Mark Hersam
Graphene derived nanocarbon architectures for energy storage 9
Quan-Hong Yang
Rational design of graphene-based nanomaterials and their application in energy 10
Storage devices
Bin Luo, Bin Wang, Linjie Zhi
Ambient Fabrication of Large-area Graphene Films via a Synchronous Reduction 12
and Assembly Strategy
Xiaodong Chen
Graphitic Carbon Nanomaterials as Metal-Free Catalysts for Energy Conversion 13
Liming Dai
Modifications of Few-layered Graphene Flakes 14
Liangbing Hu
Graphene Aerogels for High-Performance Electrical Energy Storage 15
Peter Pauzauskie, Zach Rousslang, Jennifer Hanson
Three Dimensional Graphene for Dye-sensitized Solar Cells 16
Yun Hu, Hui Wang
Porous Materials for Energy Conversion and Storage
SuperhydrophobicMesoporous Materials with Catalytically Active Sites as Efficient 17
Catalyst for Biomass Conversion
Feng-Shou Xiao
Metal Organic Frameworks catalysts in the conversion of C02 to cyclic carbonates 18
Moises Carreon
Porous metal-organic frameworks: Mechanical stabilities and methane storage 19
applications
Wei Zhou
Capacitance Dependence on the Pore Size in Electric Double Layer Capacitors 20
De-en Jiang
Electrically-Regenerated Metal-Organic Frameworks 21
Carlos Fernandez, B. McGrail, Praveen Thallapally
Revisiting the Charge Storage Mechanism of Nano-Structured Li4Ti5012 23
Zonghai Chen, Yan Qin, Yang Ren, Chengjun Sun, Steve Heald, Ira Bloom
Energy Storage by Conjugated Microporous Polymers 24
Donglin Jiang, Fei Xu, Atsushi Nagai
Understaning nanoporous NiO in p-type dye-sensitized solar cells 25
Yiying Wu
Microporous Cu-CHA materials for the selective catalytic reduction of NOx with 26
NH3: Catalyst structure/function and mechanistic studies
Feng Gao, Eric Walter, Nancy Washton, Janos Szanyi, Charles Peden
Energy-Efficient Dehumidification over Mesoporous Metal Carboxylates with 27
Hydrothermal Stability
Jong-San Chang, Ji Woong Yoon, You-Kyong Seo, Young Kyu Hwang, U-Hwang Lee, Dong Won
Hwang
Methane Storage in Metal-Organic Frameworks and Nanoporous Carbons: Current 29
Records, Surprise Findings, and Challenges
Taner Yildirim, Yang Peng, Vaiva Krungleviciute, Ibrahim Eryazici, Joseph Hupp, Omar Farha
Surface investigation of ZIF thin films 30
Lauren Benz, Andres Gomez, Amber Mosier
Synthesis-driven structural variation in redox-active mixed-metal MOFs 32
Karen Mulfort, Shenshen Li, Yu-sheng Chen
Selective gas uptake and storage in porous organic framework 33
Ali Kemal Sekizkardes, Mohammad Gulam Rabbani, Zafer Kahveci, Hani El-Kaderi
Porphyrinic Metal-Organic Frameworks: Materials design and applications 34
Wonyoung Choe
Tailoring mesoporous carbons and related materials for energy applications 35
Sheng Dai
Microalgal biodiesel production via a two-step process with biochar-based acidic 36
catalyst
Tao Dong, Difeng Gao, Chao Miao, Shulin Chen
Novel Hierarchically Porous Beta-MCFs Materials and HDS Performance of DBT 37
Xiaofeng Zhou, Huadong Wu, Aijun Duan, Zhen Zhao, Guiyuan Jiang, Jian Liu
Proton-conducting phosphonated frameworks 38
Jennifer Wegener, Anke Kaltbeitzel, Gunnar GlaBer, Robert Graf, Markus Klapper, Klaus Mullen
Nanopore-governed heterogeneous catalysis: designing selective reaction cavities 39
on metal surfaces
Chia-Kuang Tsung
In-situ FT-IR Investigation of the Decomposition of Nano Zn40(C8H404)3 Metal- 40
Organic Framework
Peifu Cheng, Yun Hu
Solar Energy Conversion and Utilization
Earth-abundant cobalt pyrite (CoS2) thin film on glass as a robust, 41
high-performance counter electrode for quantum dot-sensitized solar cells
Matthew Faber, Kwangsuk Park, Miguel Caban-Acevedo, Pralay Santra, Song Jin
Biohybrid electrodes based on Photosystem I for solar energy conversion 48
Gabriel LeBlanc, Evan Gizzie, G. Kane Jennings, David Cliffel
Emergence of Quantum Dot Solar Cells as Next Generation Photovoltaics 51
Prashant Kamat
Programmed Nanomaterials for Solar Driven Water Splitting 52
Xiaodong Chen
Novel porphyrin dyes with enhanced light absorption and binding strength for 53
dye-sensitized solar cells
Hongshan He, Liping Si, Zhixin Zhao, Wenhui Li
Solar wastewater purification via photocatalytic black Ti3+ self-doped Ti02 55
oxidized from TiH2
Lauren Grabstanowicz, Tao Xu
Semiconductors, Electrocatalysts, and Interfaces in Solar Water Splitting 57
Shannon Boettcher
Multicomponent Quantum Confined Semiconductor Nanorods: From Charge 59
Separation Dynamics to Solar-to-Fuel Conversion
Tianquan Lian, Haiming Zhu, Kaifeng Wu
Interfacial chemistry of III-V semiconductors for photoelectrochemical water 61
splitting
Brandon Wood, Eric Schwegler, Woon In Choi, Tadashi Ogitsu
Enable Pyrite as a High Performance Solar Material Using Photoelectrochemical 64
and Transport Studies of Pyrite Single Crystals and Nanostructures
Song Jin
GATR-FTIR characterization of cobaloxime modified p-type gallium phosphide 65
cathodes
Gary Moore, Alexandra Krawicz
Cyclometalated ruthenium sensitizers for p-type dye-sensitized solar cells and 67
solar fuels
Yiying Wu
Engineering novel cyclometallated dyes for efficient DSSCs: paradigm shift from 68
organic solvents to H20
suraj soman
Catalytic Water Splitting by Metal Complexes Based on Tris(2- 69
pyridylmethyl)amine Derivatives
Manohar Vennampalli, Chailu Que, Teera Baine, Min Zhang, John Bollinger, Charles Webster, Xuan
Zhao
Water-oxidation catalysis for solar fuel production 70
Gary Brudvig, Robert Crabtree, Victor Batista, Charles Schmuttenmaer
Bismuth Vanadate Photoanodes for Use in Solar Energy Conversion 71
Yiseul Park, Donghyeon Kang, Jason Seabold, Kenneth McDonald, Kyoung-Shin Choi
Enabling Si for Solar Energy Harvesting and Fuel Conversion 73
Ke Sun, Deli Wang
Metal oxide nanostructured electrodes for solar hydrogen generation 74
Yat Li
Metal oxides as effective counter electrodes for dye-sensitized solar cells 77
Hui Wang, Wei Wei, Yun Hu
Efficient ZrN-based counter electrodes for dye-sensitized solar cells 78
Wei Wei, Hui Wang, Yun Hu
Synthesis and Characterization of Bi2Ti207 with Fe addition: Examining the 79
effects of Fe on photo driven hydrogen Production
Bradley Allured, Steven DelaCruz, Muhammad Huda, Vaidyanathan (Ravi) Subramanian
Advances in Batteries, Capacitors, and Other Energy Storage Devices
Graphene-based composites as electrochemical supercapacitors 83
Zhefei Li, Jian Xie
Applications of carbide-derived carbon as electrodes for rechargeable lithium-ion 84
batteries
Sun-Hwa Yeon, Kyu-Nam Jung, Sukeun Yoon, Kyoung-Hee Shin, Jae-Deok Jeon
Thermal-induced decomposition roadmap of charged cathode material Li 1.2- 85
xNi0.15Co0.1Mn0.55O2 studied by Synchrotron X-ray Techniques
Chi-Kai Lin, Zonghai Chen, Ira Bloom, Yang Ren
Semiconductor Nanowire-arrayed Electrodes for Supercapacitors 86
Yat Li
An Enhanced Lithium Ion Battery Via Biological Engeneering 89
Scott Riley
High voltage electrolyte based on fluorinated compounds for 5V Li-ion chemistry 90
Zhengcheng Zhang, Libo Hu, Huiming Wu, Khalil Amine
Toward fully plastic batteries: Electroactive polymer-carbon composite electrode 91
as cathode material for rechargeable batteries
Burak Esat, Muhammed Aydin
Li intercalation capacity of Fe-Phthalocyanine 94
Ramos-Sanchez Guadalupe, Perla Balbuena
Pseudocapacitive energy storage in 2D Nb205-graphene nanocomposites 96
Bruce Dunn, Guillaume Muller, Hyungseok Kim, Xavier Petrissans, Veronica Augustyn
Capturing the interface in Li-ion cells with heavy alkali dopants: Raman and X-ray 98
techniques
Christopher Patridge, Corey Love, David Ramaker
Phosphate and diphosphate bimetallic cathode materials 99
Esther Takeuchi, Amy Marschilok, Kenneth Takeuchi
Electrodeposition of metal-air battery cathodes: Fabrication, characterization 100
and electrochemistry
Amy Marschilok, Shu Han Lee, Esther Takeuchi, Kenneth Takeuchi
Electrolytes for Lithium Batteries from Oligo(ethylene glycol) Functionalized 101
Cyclophosphazenes and Phosphazene Oligomers
Kinkini Roy, Zhengcheng Zhang, Khalil Amine, E Coughlin
Study of Phase changes about LiFeP04 cathode in an 18650 commercial cell: An 103
in situ time-resolved high energy synchrotron XRD study
Qi Liu, Yang Ren, Jian Xie
Fundamentals and Structure Designs for Na-ion Battery Anodes 104
Liangbing Hu
PHENOTHIAZINE-BASED REDOX SHUTTLES FOR OVERCHARGE PROTECTION IN 105
LITHIUM-ION BATTERIES
Susan Odom, Selin Ergun, Corrine Elliott, Pramod Poudel, Sean Parkin
Mechanism of oxidized redox shuttle reduction at graphite or LTO anodes 107
Mary Patterson
Fast method for screening redox shuttle additives for lithium-ion batteries 108
Pramod Poudel, Selin Ergun, Nelson Ng, Sean Parkin, Susan Odom
Probing Electrochemical Cycling Stability of Oxide Cathode Materials for Li-ion 110
batteries by Advanced Electron Microscopy
Miaofang Chi, Danna Qian, Christopher Fell, Shirley Meng
Applied research at the US DOE supporting the development of next-generation 111
batteries for plug-in electric vehicles (PEVs)
Peter Faguy
Low Cost, Abundant, Defective Materials for Large Scale Electrical Energy 112
Storage
Dan Steingart
Frontiers in Energy Conversion and Fuel Production
Growth and Characterization of Graphenated Carbon Nanotubes for High Charge 113
Density Applications
Akshay Raut, Stephen Ubnoske, Barbara Raynal, Brian Stoner, Charles Parker, Jeffrey Glass
Using sulfur K-edge XANES to better understand adsorption of S02 species on 115
PEMFC catalysts
Olga Baturina, Benjamin Gould, Anna Korovina, Paul Northrup, Karen Swider-Lyons
Electricity Storage in Biofuels: Selective Electrocatalytic Reduction of Levulinic 117
Acid to Valeric acid or y-Valerolactone
Le Xin, Zhiyong Zhang, Ji Qi, David Chadderdon, Wenzhen Li
Conversion of fat, oil and grease (FOG) in the trap grease into biodiesel 118
Qingshi Tu, Mingming Lu
Dealloyed Nanoporous Metals as unique electrodes for supercapacitor 119
applications
Yi Ding, Pengchao Si, Fanhui Meng
Chemical characterization of liquid fuels derived from Northeast-US hardwood 121
for potential application in residential heating
Asanga Padmaperuma, Daniel Santosa, Douglas Elliott, Jonathan Male, Alan Zacher, Mariefel Olarte,Leslie Rotness, Gary Neuenschwander, Teresa Lemmon, Sarah Burton, Iva Tews, Corrie Nichol, Tyler
Westover, David Muth, Richard Boardman
HIGH PERFORMANCE POLYMERIC ELECTROLYTES FOR SAFE LITHIUM-ION 123
BATTERIES
katie Zhong, Jianying Ji, Yu Wang, Bin Li
The role of chemistry in the energy challenge 125
Robert Schlogl
Electrical grid energy storage: the key to improving production costs and 127
propelling the growth of renewable electricity
Charles Coe
Bridging Cellulosic Biomass and Advanced Biofuels with Catalytic Aqueous Phase 129
Partial Oxidation
Hongfei Lin, Ying Liu, Lisha Yang
Structured catalysts for the alkylation of benzene with propylene to cumene 131
Chengna Dai, Zhigang Lei, Biaohua Chen
The effect of the ratio of edge/basal planes on the catalytic activity of graphitic 133
carbon for the oxidative dehydrogenation of isobutane
Viviane Schwartz, Yu-Tung Tsai, Wujun Fu, Adam Rondinone, Zili Wu, Steven Overbury, Gopi Dathar,
Ye Xu, Chengdu Liang
Fuel reforming using lanthanum zirconate (La2Zr207) pyrochlroes 134
James Spivey, Devendra Pakhare, Victor Abdelsayed, Daniel Haynes, Dushyant Shekhawat, Viviane
Schwartz, Mark Smith
Phosphonic acid-functionalized polymers vs. phosphonated small molecules 135
David versus Goliath?
Markus Klapper, Jennifer Wegener, Lucia Jimenez-Garda, Anke Kaltbeitzel, Klaus Mullen
Catalyzing sustainable fuel production: Development of Cu-based catalysts for 137
the hydrogenation of C02 to methanol
Julia Schumann, Nygil Thomas, Andrey Tarasov, Stefan Zander, Malte Behrens, Robert Schlogl
The power of the oxide/metal interface in catalysis: Unraveling the 138
Intermediates for the Water-Gas Shift Reaction
Dario Stacchiola
Simultaneous supercritical deposition: An alternative route for the preparation 139
of supported bimetallic catalysts for energy conversion technologies
Can Erkey, Selmi Erim Bozbag, Amir Hossein Habibi, Ayse Meric Kartal, Michael A Kurykin
Li-N Materials for Energy 141
Yun Hu
Nanostructured palladium catalysts for carbon dioxide reforming of methane 142
Chunkai Shi, Peng Zhang
CRYSTAL-SIZE'S EFFECT ON DEFECT AND CRYSTAL STRUCTURE IN NANO- OXIDES 144
OF Ce & Zr
Siu-Wai Chan
Features of Nanocomposite Ni-Zr02 Catalyst for Syngas and Hydrogen Production 147
from Methane
Bo-Qing Xu
Direct synthesis of jet fuel range branched alkanes with the platform chemicals 148
from lignocellulose
Guangyi Li, Jinfan Yang, Ning Li, Aiqin Wang, Tao Zhang
Catalysis and Catalysts for Energy and Fuels
In situ Raman characterization of benzenethiol electrochemical
adsorption/desorption on Pd nanostructures
150
Michael Pomfret, Jeremy Pietron
Conversion of triglycerides and fatty acids to fuel-like hydrocarbons over 152
supported nickel catalysts
Eduardo Santillan-Jimenez, Tonya Morgan, Mark Crocker
Non-oxidative conversion of methane into aromatic compounds over promoted 154
Zn/HZSM-5 catalysts
Victor Abdelsayed, Dushyant Shekhawat, Mark Smith, Sittichai Natesakhawat
In Situ Investigation of a-Mn02 Electrocatalyst during Electrochemical Cycling 155
Probed by High-Energy Synchrotron X-ray Diffraction
ZHENZHEN YANG, Lynn Trahey, Maria Chan, Chikai Lin, Michael Thackeray, Yang Ren
Semiconductor Nanowire-Molybdenum Interface for Hydrogen Evolution 156
Ruoxue Yan, Peidong Yang
Precise Control of Ullmann Coupling Reactions at Atomically Flat Surfaces 157
Kai Wu
Nanoscale catalytic materials and their applications in energy and fuels 158
Ryan Richards
CO hydrogenation to higher alcohols over three-dimensionally ordered 159
macroporous Cu-Fe Catalysts
Yongwu Lu, Fei Yu, Jin Hu, Peng Zhou
Syntheis of Acidic Ionic Liquids Functionalized Ordered Mesoporous Polymer for 161
Efficient, Green and Low Cost Production of Biodiesel from waste brown grease
Iman Noshadi, Baishali Kanjilal, Fujian Liu, Richard Parnas
Study on adsorbents for removing thiophene from gasoline 162
Xiangnan Zheng, Yabo Hou, Meihua Tang, Xingliang Huang
Operando XAFS-TEM-Raman methodology for nano-catalysts 164
Yuanyuan Li, Anatoly Frenkel, Philipp Baumann, Ryan Tappero, Dmitri Zakharov, Eric Stach
Highly Active and Stable Supported FeCuK FT Catalyst 165
Kamyar Keyvanloo, William Hecker, Calvin Bartholomew
Anchoring of PtRu particles to Graphitic Carbon Nanofibers studied by density 167
functional theory calculations
Andrew Harris, Charles Lukehart, Henrik Grbnbeck
Graphene-enhanced Raman spectroscopy to study oxygen reduction in 169
non-precious metal electrocatalysts
Justin Oberst, Andrew Gewirth
Catalytic cracking of coybean oil by hierarchical zeolite containing mesoporous 171
silica-aluminas using a Curie point pyrolyzer
Atsushi Ishihara
Homologation of methanol for production of ethanol using homogeneous 173
catalysis
Girish Srinivas, Jeffrey Martin, Steven Gebhard, Michael Mundschau
Platinum-free Fuel Cell Catalysts prepared by Carbonization of Polymers 175
Yuta Nabae
Thermally stable core-shell catalysts for high-temperature fuel cells 177
John Vohs, Raymond Gorte, Lawrence Adijanto, Matteo Cargnello
Environmental TEM for quantitative in-situ microscopy in catalyst chemistry at 178
the atomic scale
Seiji Takeda, Hideto Yoshida
Complete water splitting on dye modified Photocatalyst; from KTa(Zr)03 to 179
Ga(Zn)N(0)
Tatsumi Ishihara, Hidehisa Hagiwara, Shintaro Ida
Photocatalytic water splitting on GaN:ZnO modified with expanded porphyrin for 181
solar energy harvesting
Hidehisa Hagiwara, Chihiro Seto, Shintaro Ida, Tatsumi Ishihara
Propane dehydrogenation by heterogeneous isolated site Fe(II) on silica catalyst 183
Bo Hu, Neil Schweitzer, Michael Lanci, Jeffrey Miller, Adam Hock
Activity relationships between aqueous phase reforming and water gas shift 185
Fred Sollberger, Paul Dietrich, Kaiwalya Sabnis, M. Cem Akatay, W. Nicholas Delgass, Fabio Ribeiro,
Jeffrey Miller
Steam reforming of glycerol over Ni/y-AI203 for hydrogen production: Effect of 187
catalyst loadindg, calcination and reaction temperature
Ahmed Umar, John Irvine
How silica grafting can improve the residue hydroconversion of alumina- 190
aupported NiMo catalysts
Guillaume Magendie, Bertrand Guichard, Alexandra Chaumonnot, Didier Espinat
Luminescence Spectroscopy assesses the Composition of the Reaction Medium 192
Neighboring a Catalytic Site
Robert Weber, Lelia Cosembescu, Vassiliki-Alexandra Glezakou, Abhijeet Karkamkar, Birgit Schwenzer,
Zheming Wang
Catalysis and mixed reactant fuel cells 193
Ilan Riess
UPGRADING OF PYROLYSIS OIL BY HYDROPROCESSING IN A PACKED BED FLOW 194
REACTOR
Divya Parapati, Venkata Penmetsa, Vamshi Guda, Philip Steele
Effect of Different Structural Promoters on Fe/Cu/K Fisher- Tropsch Catalysts 197
Conversion of Biomass-Derived Syngas
Pratibha Sharma, Thomas Elder, Les Groom, James Spivey, Khiet Mai
Metal-free Oxidative Dehydrogenation of Isobutane by Functionalized Carbon 198
Gopi Krishna Phani Dathar, Ye Xu, Yu-tung Tsai, Viviane Schwartz, Adam Rondinone, Steve Overbury,
Zili Wu, Chengdu Liang
In-situ intermediate-energy X-ray catalysis research at the Advanced Photon 199
Source beamline 9-BM
Trudy Bolin, Tianpin Wu, Neil Schweitzer, Rodrigo Lobo-Lapidus, A. Jeremy Kropf, Hui Wang,
Yongfeng Hu, Jeffrey Miller, Steven Heald
Catalyst Activity and Deactivation Mechanisms of C1-C4 n-Alcohols over HZSM-5 202
in Producing Fuel Range Hydrocarbon
Karthikeyan Ramasamy, Yong Wang
Synthesis and Characterization of Molybdenum Incorporated Mesoporous Silica 204
Catalyst for Catalytic Upgrading of Bio-fuels
Sridhar Budhi, Calvin Mukarakate, Pranjal Kalita, Mark Nimlos, Brian Trewyn
Lattice-governed electrochemical catalysis: Pd-Rh nanoboxes synthesized via 206
control of metal migration
Chia-Kuang Tsung
Co-processing CH4 and Oxygenates on Mo/H-ZSM-5 Catalysts 207
Jeremy Bedard, Aditya Bhan, Do-Young Hong
NON NOBLE ELECTROCATALYSTS SUPPORTED ON GRAPHENE SHEETS FOR 208
OXYGEN REDUCTION REACTION
Alessandro Monteverde Videla, Shuai Ban, Lei Zhang, Jiujun Zhang, Stefania Specchia
Biomass and Biotechnologies for Energy
Impact of torrefaction on chemical structure of woody biomass 210
Tooran Khazraie Shoulaifar, Nikolai DeMartini, Maria Zevenhoven, Stefan Willfor, Andrey Pranovich,
Annika Smeds, Tommi Virtanen, Sirkka-Liisa Maunu, Fred Verhoeff, Jaap Kiel, Mikko Hupa
Experimental and Simulation study of crude glycerol purification from different 211
feed stocks in biodiesel production
Yang Xiao, Arvind Varma
Effect of acetate and butyrate cycling on maximizing fermentative production of 212
1,3 propanediol from industrial waste glycerol and soil based bacterial innocula
Baishali Kanjilal, Iman Noshadi, Nicholas Intoci, Matthew Dowding, William Hale, Brittany Brendel,
Ranjan Srivastava, Richard Parnas
Fast hydropyrolysis of cellulose in a continuous feed millisecond timescale 214
reactor
Dhairya Mehta, W. Nicholas Delgass, Rakesh Agrawal, Fabio Ribeiro
Electrocatalytic Upgrading of Bio-oil Model Compounds in a Solid Polymer 215
Electrolyte Electrolyzer (SPEE)
Chun Ho Lam, Kelsey Longe, Michaelyn Lux, Christopher Saffron, James Jackson
Renewable energy production through anaerobic codigestion of Hura crepitans 217
leaves with cattle manure
Favour Akpa
GAS GENERATION IN A MICROREACTOR FROM A RENEWABLE RESOURCE 219
Laura Barrio, U. Izquierdo, J. Requies, M.B. Guemez, J.F. Cambra, P.L. Arias
Modeling biomass-to-fuels processing
Brian Moreno, Michael Klein
221
Scientific and technological aspects of fixed bed biomass gasification
Dasappa 5
224
Integrated use of spend coffee grounds in biodiesel production
Ming Chai, Qingshi Tu, Mingming Lu
225
Synthesis and evaluation of catalytic biomass-to-fuels strategies 228
Sercan Sen, David Alonso, Elif Gurbuz, Stephanie Wettstein, James Dumesic, Christos Maravelias
Mariefel Olarte, Douglas Elliott, Gary Neuenschwander, Leslie Rotness, Sarah Burton, Birgit
Schwenzer, Asanga Padmaperuma, Alan Zacher
Changes in lignin properties during liquid hot water pretreatment and its role on 232
enzymatic hydrolysis
Ja Kyong Ko, Youngmi Kim, Eduardo Ximenes, Michael Ladisch
Quality Characteristics of a Heavy Gasoil - Used Cooking Oil Co-Hydroprocessing 234
Fuel and Its Distillation Cuts
Dimitrios Karonis, Despina Chilari, Pantelis Lambrinoudakis
Tetramethylguanidine - Catalyzed Transesterification for Fatty Acid Ethyl Esters 238
(FAEE) Production
Despina Chilari, George Anastopoulos, Dimitrios Karonis
Effect of recycle of non-condensable pyrolysis gases on fractional catalytic 242
pyrolysis of biomass
Foster Agblevor, Ofei Mante, Ronald McClung, Ted Oyama
Effect of hot gas filtration (HGF) on catalyst activity during ex-situ catalytic fast 245
pyrolysis of biomass
Calvin Mukarakate, Xiaodong Zhang, David Robichaud, Mark Nimlos
Robust Distributed Benthic Microbial Fuel Cell (DBMFC) System to Harvest 247
Electric Energy from Sediment
Udayarka Karra, Guoxian Huang, Ridvan Umaz, Christopher Tenaglier, Lei Wang, Xiujun Wang, Baikun
Li
Progress towards infrastructure- ready thermochemical biofuels 248
Foster Agblevor, Ofei Mante
Towards long-term fast pyrolysis oil catalytic upgrading 230
Nanotechnology Applications in Energy
Advanced Nanostructured Thermoelectric Materials for Waste Heat Recovery 249
Yue Wu
Nanomaterials as Interfacial Modifiers in Advanced Energy Applications 250
Randy Vander Wal
Development of nanoscale electrocatalysts for energy storage and conversion 253
applications
Peter Strasser
PbTe nanocrystal coated glass fiber for thermoelectric energy harvesting
Scott Finefrock, Daxin Liang, James Ward, Yue Wu, Yan Wang, Haoran Yang, Haiyu Fang,
Fergsuson, Jonathan Pfluger, Douglas Dudis, Xiulin Ruan
Solution phase synthesized dumbbell-like PbTe-Ag2Te heterestructures with
enhanced Seebeck coefficient for thermoelectric applications
Haoran Yang, Yue Wu
Highly efficient nanoparticle catalyst for fuel cell applications
Shouheng Sun
Precision Design of Nanostructures of Catalysts for Energy Applications
Hong Yang
Transition Metallic Sulfides/Graphene Composites: Synthesis and High
Performance for Lithium Ion Batteries and Oxygen Reduction Reaction
Yanglong Hou, Nasir Mahmood, Chenzhen Zhang
Density Functional Theory Study of Oxygen Reduction Reaction on Carbon 261
Supported Non-precious Transition Metal-Nitrogen (TM-N/C) Electrocatalysts
Guofeng Wang, Shyam Kattel, Kexi Liu
Synthesis and thermoelectric properties of compositional-modulated lead 263
telluride-bismuth telluride nanowire heterostructures
Haiyu Fang, Tianli Feng, Haoran Yang, Xiulin Ruan, Yue Wu
Surface Plasmon Enhanced Photocatalysis 265
Yugang Sun
Towards the rational design of nanoparticles for energy applications 267
Tim Mueller
Density Functional Theory Studies of Transition Metal Nanoparticles in Catalysis 269
Jeffrey Greeley, Rees Rankin, Zhenhua Zeng, Hee-Joon Chun, Andre Clayborne, Lin Li, Frank Abild-
Pedersen, Jens Norskov, Ask La;sen, Jesper Kleis, Karsten Jacobsen, Nichols Romero
Energetic nanoparticle formation by the thermal decomposition of alanates 270
Brandon Thomas, Paul Jelliss, Steven Buckner
Solution based synthesis of Cu3PS4 from Cu3P for sustainable alternative 272
energy applications
Erik Sheets, Rakesh Agrawal
Probing Hot Electron Dynamics in Plasmonic Metal-Semiconductor (Au-Ti02) 274
Heterojunctions
Wei David Wei
254
John
256
258
259
260
Nanoscale Materials at Electrochemical Interfaces 275
Vojislav Stamenkovic
Nanoporous Metal-Organic Frameworks for Hydrogen Storage 276
Shengqian Ma
Conducting Polymer Hydrogels as a Unique Material Platform for Advanced 277
Energy Storage
Guihua Yu
Platinum-nickel alloy nanoparticle oxygen reduction catalysts from a DMF-based 278
solvothermal synthesis
Michael Carpenter, Thomas Moylan, Ratandeep Kukreja, Mohammed Atwan, Misle Tessema
Water-Gas Shift Catalysis over Transition Metals Supported on Molybdenum 280
Carbide
Kaiwalya Sabnis, Yanran Cui, Fred Sollberger, M. Cem Akatay, Mayank Shekhar, Wen-Sheng Lee,
Jeffrey Miller, W. Nicholas Delgass, Fabio Ribeiro
Polyelectrolyte Stabilized Nanoparticles for PEM Fuel Cells 282
Nicole Zacharia, Chungyeon Cho
Synthesis and properties of epitaxial PbSe QD-Ti02 nanoscale heterostructures 283
for solar energy conversion
Qi Ding, Fei Meng, Tristan Abbott, Song Jin
Photoelectrochemical Energy Conversion and Electrocatalytic Hydrogen Evolution 285
Using Earth-Abundant Nanomaterials
Song Jin
Metal-organic frameworks as electrocatalysts for oxygen reduction reaction 287
Thomas Smith, Paul Barron, Brandon Burnett, Wonyoung Choe, Rebecca Lai
Synchrotron x-ray and neutron studies of nanomaterials and nanocomposites for 288
energy applications
Zonghai Zhen, Yang Ren
3-D Nanowire Heterostructures for High-efficiency Solar Energy Harvesting and 289
Photoelectrochemical Hydrogen Generation
Ke Sun, Alireza Kargar, Sun Young Noh, Deli Wang
Assembly and processing of bulk 2D nanomaterials for energy applications 290
Jiaxing Huang
The effect of surface lattice strain in electrochemical oxidation catalyzed by 291
Au-PdPt core-shell nanoparticles
Chia-Kuang Tsung
Biodiesel production using surface-bound ZnO nanowires 292
Ruya Ozer
In-situ FTIR Investigation on Ti02 reduction 294
Bing Han, Yun Hu
Scalable Nanomanufacturing for Energy Storage and Conversion Based on 295
High-Voltage Electrophoretic Deposition
Dennis Desheng Meng
Advances in Energy and Fuels Processes, Systems, Materials, and
Utilization
Separation of nitrogen via Group V metallic membranes for post-combustion 296
carbon capture
Kyoungjin Lee, Ekin Ozdogan, Jennifer Wilcox
The effects of Pr addition on the properties of Ni/AI203 catalysts with an 299
application in autothermal reforming of methane
Ying Wang, Jun Peng, Shuang Ye, Wei Guo Wang
Influence of Catalyst on the Synthesis of Cationic Alkyl Glucoside 301
Xiqiang Si, Zhonghua Wang, Jun Wei, Jianwu Zhen
Development of Facet-Controlled Pt and Pt Alloy Nanocatalysts for Oxygen 302
Reduction Reaction
Xi Yin, Jianbo Wu, Wei Zhou, Tao Yang, Hong Yang
Carbon deposition mechanism and kinetics during thermal cracking of 303
supercritical n-decane
Xuqing Wang, Guozhu Liu, Li Wang, Xiangwen Zhang
Synthesis of Tungsten Disulfide on Graphene for Hydrogen Evolution Reaction 306
Jieun Yang, Damien Voiry, Chandra Sekhar Rout, Byeong-Hwan Kim, Manish Chhowalla, Hyeon Suk
Shin
Preparation of In-rich CuInSe2 photovoltaic films by varying the concentration of 308
sorbitol as the third complexing agent
Young-II Park, Donghwan Kim, Honggon Kim
Electrochemical production of syngas from carbon dioxide and water as an 309
economically competitive source of JP-8
George Leonard, Kunttal Keyshar, Kyle Teamey, Robert Stirling, Zach Detweiler, Maor Baruch, Yong
Yan, David Rampulla, Narayanappa Sivasankar, Emily Cole
Polyelectrolyte Multilayers for Enhanced Performance of Reverse Osmosis 311
Membranes
Sarah Powers, Ryan Davis, Hsiu-chin Huang, Nicole Zacharia
Analysis of slow - pyrolysis bio-oils generated from plant biomass by negative 312
electrospray ionization - high resolution mass spectrometry
Birendra Dhungana, Christopher Becker, William Hockaday, C. Chambliss
Synthesis of n-Extended Low Bandgap Polymer Based on Isoindigo and 314
Thienylvinylene for High-Performance Polymer Solar Cells
Eui Hyuk Jung, Won Ho Jo
Enhanced Performance of Polymer Solar Cells with PSSA-g-PANI/Graphene 316
Oxide as Hole Transport Layer
Seunghwan Bae, Heung-su Park, Jae Woong Jung, Jea Uk Lee, Kyung Tae Kim, Won Ho Jo
Towards models of the tri-copper active site of Lacease for fuel cell applications 318
Chun Ming Edmund Tse, Andrew Gewirth, Matthew Thorseth
Poly(vinyl alcohol) filled with poly(dopamine)-treated graphene oxide 320
Dongwoo Kang, Sang-Ha Hwang, Young-Bin Park, Hyeon Suk Shin
Investigating the Li-02 Battery in an Ether-Based Electrolyte using Differential 322
Electrochemical Mass Spectrometry
Christopher Barile, Andrew Gewirth
Novel cyclometallated osmium dyes for dye sensitized solar cells 324
Suraj Soman, Thomas Hamann
Mo-V-O based electrocatalysts for low temperature alcohol oxidation 325
Adele Pacquette, Andrew Gewirth
Cu-Catalyzed Reduction of C02 into formic acid with iron under mild 327
hydrothermal conditions
Lin Ma, Xu Zeng, Jun Yun, Fangming Jin, Zhibao Huo
Reduction of carbon dioxide with hydrogen sulphide as a reductant under 329
hydrothermal conditions
baoyun Hu, zhenzi Jing, yuanqing Wang, xu Zeng, fangming Jin
Potentials for GTL derived synthetic jet fuels in the aviation industry 331
Ibrahim Al-Nuaimi, Nimir Elbashir
High performance hydrogen evolution catalysis from layered transition metal 334
dichalcogenide nanostructures
Andrew Daniel, Mark Lukowski, Fei Meng, Audrey Forticaux, Linsen Li, Song Jin
Direct chemical vapor deposition synthesis of phase-pure iron pyrite thin films 336
Leith Samad, Miguel Caban-Acevedo, Song Jin
Azo-functionalized porous membranes for gas separation 338
Chi-Linh Do-Thanh, Xiang Zhu, Sheng Dai
Catalytic Dehydrogenation of Ethane over Au(I) exchanged ZSM-5: A DFT Study 339
Winyoo Sangthong, Michael Probst, Jumras Limtrakul
Aqueous dye sensitized solar cell based on novel cyclometallated ruthenium 342
phosphonic acid dyes
Suraj Soman, Thomas Hamann
Capping and stabilization of Zinc nanoparticles producedby electrical explosion 343
of wires using PIERMEN
Elseddik Abdelkader, Steven Buckner, Paul Jelliss
Development of Bismuth Sulfide nanostructured materials and nanomaterial 345
assemblies
Gayatri Keskar, Rebecca Milot, Daniel Aschaffenburg, Charles Schmuttenmaer, Lisa Pfefferle
THEORETICAL SIMULATIONS OF THE HREELS OF CO, CH20 AND CH30 ON 346
PD(lll) AND PDZN(lll)
Zhao-Xu Chen
Materials and Technologies for C02 Capture, Sequestration, and
Conversion
Post combustion C02 capture: rapid temperature swing adsorption/desorption 347
using polymeric supported amine hollow fibers
Yanfang Fan, Ryan Lively, Ying Labreche, William Koros, Christopher Jones, Fateme Rezaei
Direct conversion of C02 into biopolyester with solar energy and water 350
Jian Yu, Allexz Dow
Quantum Chemistry Calculation and Experimental Study of C02/CH4 and 351
Functional Group Interactions for the Design of Solubility Selective Membrane Materials
Decai Yu, Scott Matteucci, Eric Stangland, Edward Calverley, Heidi Wegener, Denise Anaya
In situ Transformation of Carbon Dioxide upon Carbon Capture with 352
Simultaneous Activation
Liang-Nian He, Zhen-Zhen Yang, An-Hua Liu
Influence of amine structural characteristics on N-nitrosamine formation 354
potential relevant to post-combustion carbon dioxide capture systems
Ning Dai, William Mitch
Potential Impact of Biochar Water-Extractable Substances on 357
Environmental Sustainability
Cameron Smith, Eric Buzan, James Lee
Separation of C02 from flue gas via semi-clathrates formationwith TBAF 358
Qiang Sun, Xuqiang Guo
Reactivity of C02 and S02 with diethylenetriamine (DETA) and its salts 359
Jason Clyburne, Kirstin Doyle, Luke Murphy, Katherine Robertson
Structure-property study of the kinetics of reaction between primary and 361
secondary amines and carbon dioxide in water
Gabriel Couchaux, Alexandre Fontenay, Danielle Barth, Abdelaziz Faraj, Theodorus De Bruin, Javier
Perez-Pellitero, Julien Grandjean
Process and Thermodynamics Considerations of C02 Capture from 363
Post-Combustion Flue Gases
Shiaoguo Chen
Conversion of N-Alkyl Aziridines plus Carbon Dioxide to Oxazolidinones 364
Allan Pinhas
Designing Ultra-High Specific Surface Area Carbon Capture Units - Learning from 366
the Avian Lung
Aaron Esser-Kahn, Du Nguyen, Y. T. Leho
Amine adsorbents for C02 capture from ultra-dilute sources such as ambient air 367
Christopher Jones, Stephanie Didas, Peter Eisenberger
Hydrogeneration of various compounds in the presence of heterogeneous 368
catalysts in scC02
Hajime Kawanami, Takayuki Ishizaka, Maya Chatterjee
Carbon dioxide capture by reactive absorption - modeling and simulation using 370
rate-based models
Michael Wagner, Inga von Harbou, Gerd Maurer, Hans Hasse
Polyallylamine-silica composites for C02 capture via adsorption 372
Gregory Knowles, Jinyi Zhuang, Carola Stenz, Alan Chaffee
Synthesis and characterization of triazolium-based ionic liquids to verify effect of 374
side groups on properties predicted by molecular simulation
Michael Lartey, Fangyon Yan, Erik Albenze, Sage Bowser, Krishnan Damodaran, Jihan Kim, Maciej
Haranczyk, Berend Smit, David Luebke, Hunaid Nulwala
Ni-modified molybdenum carbide catalysts effective for Methane Dry Reforming 375
at atmospheric pressure
Chuan Shi, Shaohua Zhang, Anjie Zhang, Chaktong Au
Post-Combustion C02 Capture by Adsorption - a Theoretical Comparison of TSA, 376
VSA and CSA
Gerhard Pirngruber, Damien Leinekugel-le-Cocq, Florent Guillou, Adrien Gomez, Alain Favre, Ludovic
Raynal
Finding the optimal adsorbent for C02 separations by PSA 378
Gerhard Pirngruber, Edder Garcia, Javier Perez-Pellitero, Christian Jallut
Soils and the global carbon cycle 379
Rattan Lai
Biomimetic approaches to reversible C02 capture from air. N-Methylcarbaminic 381
acid formation in Rubisco-inspired models
Rainer Glaser, Paula Castello-Blindt, Jian Yin
Novel Carbon Capture and Sequestration: Biomimetic Solid Sorbents and Gas 384
Shale Analysis
Jennifer Wilcox, Erik Rupp, Jiajun He
Computational design of ceria-based catalysts for carbon dioxide activation and 387
hydrogenation
Zhuo Cheng, Brent Sherman, Cynthia Lo
Absorption Mechanism in C02 Capture with Amino Acid Ionic Liquids: 389
Experimental and Simulation Studies
Huabin Xing, Zhiping Wang, Qiwei Yang, Zongbi Bao, Baogen Su, Zhiguo Zhang, Yiwen Yang, Qilong
Ren, Sheng Dai
Highly efficient dissociation of H20 for the reduction of C02 by solar/renewable 390
energy-driven two-step process
Fangming Jin, Xu Zeng, Zhibao Huo, Jun Yun
Modeling of C02 absorption in and stripping from aqueous solutions of amines, 392
amino acids, alkali, inorganic buffers and hydration catalysts, and blends thereof
Jerry Meldon, Andrew Fiordalis
The hybrid energy system: a solution to C02 emission in China? 394
zhiyong TANG, yuhan SUN
ACTIVATION OF THE C02 MOLECULES, A THEORETICAL STUDY 395
Shin Nakamura, Katsushi Fujii, Koji Ogata, Makoto Hatakeyama, Xu Zeng, Yuanqing Wang, Qi Gao,
Fangming Jin
C02 capture with PEI-functionalized nanocarbons 396
Eoghan Dillon, Enrico Andreoli, Laurie Cullum, Andrew Barron
Reduction of C02 into formic acid BY Mn under hydrothermal conditions 398
Lingyun Lv, Xu Zeng, Jun Yun, Fangming Jin
International Graduate Symposium on Energy Research
Experimental study on the separation of catalystic pyrolysis dry gas via hydrate 400
formation in TBAB solution
Zhixin Liao, Qing Li, Tianxiao Wang, Yiwei Wang, Xuqiang Guo, Qiang Sun
Support materials for catalysts for electrochemical reduction of C02 to value 401
added products
Sichao Ma, Gaby Perez, Saman Moniri, Paul Kenis
Bismuth oxyhalide visible-light-driven BiOBrxIl-x solid solutions: Essences for 403
the highly efficient photocatalyst
LIANG KONG, ZHENG JIANG, HENRY LAI, JOSHUA MAKEPEACE, TIANCUN XIAO, PETER EDWARDS
Hydrothermal deoxygenation of algal bio-oil rich in fatty acid 410
Chao Miao, Moumita Chakraborty, Oscar Marin Flores, Yong Wang, Shulin Chen, Tao Dong
Robust Iron Pincer Complexes for Catalytic Dehydrogenation of Ammonia-Borane 411
Papri Bhattacharya, Jeanette Krause, Hairong Guan
Effect of Hydrogen Sulfide in Landfill Gas on Anode Poisoning of Solid Oxide Fuel 412
Cells
feroze khan
Unusual fragmentation patterns of lignin model compounds with a-O-4 linkages 414
in (+)-ESI/tandem mass spectrometry
Huaming Sheng, Weijuan Tang, Hilkka Kenttamaa
Hydrothermal liquefaction of waste water algae mixtures into biocrude oil 416
Wan-Ting Chen, Yuanhui Zhang, Jixiang Zhang, Peng Zhang
X-ray absorption study on nucleation of Sn02 thin films grown by Atomic Layer 418
Deposition
Matthew Weimer, Bo Hu, Steven Kraft, Carlo Segre, Adam Hock
Optimization-based assessment framework for biomass-to-fuel conversion 420
strategies
Sercan Sen, Jiyong Kim, Christos Maravelias
Structural Comparison of Asphaltenes of Different Origins by Using Tandem Mass 422
Spectrometry
Weijuan Tang, Matthew Hurt, Huaming Sheng, James Riedeman, David Borton, Hilkka Kenttamaa
Thermochemical modeling of the Ul-yGdy02±x phase 424
Jake McMurray
Photoconductive atomic force microscopy of a conjugated polyelectrolyte/multi- 426
walled carbon nanotube hybrid
Kin Cheung Lo, Wai Kin Chan, Sheung Yin Li
DNA aptamers for redox cofactors as possible catalysts for biofuel cells 428
Ismaila Emahi, Derek Sonnenberg, Dana Baum
Composite Carbon Nanotube and Titania Supports for Resilent Oxidation 430
Electrocatalysts in Polymer Electrolyte Fuel Cells
William Rigdon, Diana Larrabee, Xinyu Huang
Graphene nanoflakes carbon nanotubes hybrid as highly robust catalyst support 431
in proton exchange membrane fuel cells
Kien-Cuong Pham, Daniel Chua, David McPhail, Andrew Wee
Density Functional Theory study of the structural and thermodynamical 433
properties of hydrogen vacancies in PdH0.7
Kay Rigby, Ricardo Grau-Crespo, Nora de Leeuw
Hydrogen Energy
Geometrical Effect Study in Mg-Based BCC Structure Nano-materials 436
Huaiyu Shao, Etsuo Akiba
Towards sustainable energy: Hydrogen production from biomass 438
Martin Nielsen, Matthias Beller
Development of High-pressure hydrogen and oxygen production from PEMWE 439
stack
xinrong zhang
Immobilization of Zn(l-x)CdxS (x=0.2-0.5) on MAO Ti02 film and the 441
photocalytic property for H2 production
xiaoliang mo, yajun zhang, lei wang, bin chen, zhaohua jiang, zhongping yao
Simple Approach of Layer-by-Layer of Proton Donor and Accepter for Effective 444
and Efficient Proton Transfer System in Polymer Electrolyte Membrane Fuel Cell (PEMFC)
Chalanda Meemuk, Suwabun Chirachanchai
Steam Reforming of Hydrogen Sulfide to Enable a New Thermochemical Cycle for 445
Hydrogen Production
Alex Yokochi, Nick AuYeung, Kevin Caple
Development of an on-board H2 storage and recovery system based on lithium 447
borohydride
Clovis Linkous
Direct Doping of Pd Nanocatalysts in Metal Complex for Enhanced Hydriding 449
Kinetics
Tao Xu
High performance solid oxide fuel cells utilizing two-dimensional oxide 451
membranes
Kian Kerman, Shriram Ramanathan
First and second law thermodynamic analysis of biomass gasification 453
Dasappa S, Sandeep Kumar
Hydrogen and Oxygen coadsorption on Iron surface. Insights from theory 454
Aleksandar Staykov, Junichiro Yamabe, Brian Somerday
Insight into the hydrogen generation from formic acid in the presence of 456
Ru-phosphine complexes
Miklos Czaun, Alain Goeppert, Jotheeswari Kothandaraman, Robert May, J. K. Surya Prakash, George
Olah
Integrated micro PEM fuel cell with self-regulated hydrogen generation from 457
ammonia borane
Mahmoud Reza Zamani Farahani, Arash Edalatnoor, Nate Kroodsma, Dennis Meng, Likun Zhu
1st International Symposium on Mesoporous Zeolites
Mesoporous Zeolite Templated from Cationic Polymers 459
Feng-Shou Xiao
Catalytic fast pyrolysis of lignocellulosic biomass by MFI zeolites with small 460
intracrystal mesopores and interparticle meso/macropores
Konstantinos Triantafyllidis, Stamatia Karakoulia, Konstantinos Kalogiannis, Angelos Lappas, Thomas
Pinnavaia
Mesostructured Zeolites: Surfactant-Templated Hierarchical Zeolites Used at 462
Refinery Scale
Javier Garcia-Martinez, Kunhac Li, Barry Speronello
Transport properties of mesoporous zeolites: Towards intelligent structure 464
design
Rustem Valiullin
Self-pillared zeolite nanosheets 466
Michael Tsapatsis
Confined synthesis of three-dimensionally ordered mesoporous-imprinted 467
zeolites with tunable morphology and Si/AI ratio
Wei Fan, Zhuopeng Wang, Chang Chun-Chih
Probing 3D pore structure in zeolites by electron microscopy 469
Xiaodong Zou, Tom Willhammar, Daliang Zhang, Wei Wan, Changhong Xiao, Junliang Sun
Effects of steam-assisted crystallization synthesis conditions on the mesopore 471
properties of hierarchical ZSM-5
Gregory Neumann, Brian Pimentel, Quan Do, Jason Hicks
Synthesized and Catalytic Performance of Composite Micro/Mesporous Material 473
L-SBA-15 for FCC Gasoline Hydro-upgrading
Tianshu Li, Huan Niu, Aijun Duan, Zhen Zhao, Guiyuan Jiang, Jian Liu, Yuechang Wei, Huifang Hui,
Baijun Liu
Growth of Vertical Mesoporous Silica Channels via Cooperative Assemblies at 474
Interfaces
Kun-Che Kao, Cheng-Han Lin, Yi-Hsin Liu, Chung-Yuan Mou
The Role of Oxides in Catalysis: Structure, Selectivity and Stability
From oxide film supported nanoparticles to two-dimensional zeolite films 476
Hajo Freund
Oxidation catalysis by doped oxides 477
Horia Metiu, Eric McFarland
THE UNUSUAL CHEMISTRY OF OXIDES AT THE NANOSCALE 478
Gianfranco Pacchioni, Livia Giordano, Hsin-Yi Tiffany Chen, Stefano Prada
In situ, real-time, spatially resolved, 3D and total-reflection XAFS for the 479
rational design and characterization of surfaces and properties of well-defined and
nanoparticle catalysts
Yasuhiro Iwasawa
Surface segregation in bi-cationic oxides is crucial for selective oxidation 480
catalysis
Michael Bowker
Enhancing the reducibility of Ce02: The role of divalent dopants 481
Aoife Kehoe, Graeme Watson, David Scanlon
Determination of Effect of the Oxide Support for the Water-Gas Shift Reaction 484
over Supported Au and Pt Nanoparticles
Kaiwalya Sabnis, Yanran Cui, Mayank Shekhar, W. Damion Williams, Wen-Sheng Lee, M. Cem Akatay,
Jeffrey Miller, W. Nicholas Delgass, Fabio Ribeiro
Coupled proton and polaron kinetics on reduced rutile (110) Ti02 surface 485
Yeohoon Yoon, Christopher Mundy, Joost VandeVondele, Roger Rousseau
Investigations of reactions over inverse CeOx-CuyO/Cu(lll) and 486
Ti02-CuyO/Cu(lll) model catalysts
Kumudu Mudiyanselage, Sanjaya Senanayake, Ashleigh Baber, Shankhamala Kundu, Dario Stacchiola
Cubic Ce203 phase studied by photoelectron spectroscopy and photoelectron 489
diffraction
Tomas Duchon, Marie Aulicka, Katefina Veltruska, Vladimir Matolin
Theoretical insights into metal oxide nanocatalysts 491
Ping Liu
Structure and Properties of Metal Dopant/Ceria Mixed Oxide Interfaces 492
Jing Zhou, Elfrida Ginting, Yinghui Zhou
Role of the surface oxygen vacancies in CO oxidation catalyzed by gold 495
supported on yttrium modified anatase
Javier Fdez Sanz, J. J. Plata, A. Marquez, F. Romero-Sarria, O.H. Laguna, M.A. Centeno, J.A.
Odriozola
Structure Dependence in Acetaldehyde reactions on Ce02 Studied Using 496
Monolithic and Nanoscopic Single Crystal Surfaces
Zili Wu, Steven Overbury, Amanda Peterson-Mann, Florencia Calaza, David Mullins, Peter Albrecht, Ye
Xu, Meijun Li
Electronic metal-oxide support interactions and the production of hydrogen 498
through the water-gas shift reaction
Jose Rodriguez, Sanjaya Senanayake, Dario Stacchiola, Ping Liu
Structure, Selectivity and Stability of Rh substituted pyrochlroes for dry (C02) 499
reforming of CH4
James Spivey, Devendra Pakhare, Viviane Schwartz, Victor Abdelsayed, Daniel Haynes, Dushyant
Shekhawat
Functions of transition metal oxides in renewable energy and fuel production 500
Xianqin Wang, Zhong He
A DFT Study of Formaldehyde Bonding on TiO2(110) and SnO2(110) 501
Miru Tang, Qingfeng Ge
Advances in Analytical Methods in Petroleum Upstream Applications
Surrounding and solving analytical problems with Data Fusion 502
Thomas Dearing, Brian Marquardt, Rachel Mohler, Carl Rechsteiner Jr.
Determination of naphthenic acids partitioning in water-crude oil systems 505
through 1-D high-field NMR spectroscopy
Teresa Lehmann, Mehrnoosh Moradi, Elena Topchiy, Vladimir Alvarado
Olefin content estimation in heavy oil, bitumen and their upgraded products 507
Lante Carbognani, Francisco Lopez-Linares, Marianna Trujillo, Qiao Wu, Josune Carbognani, Pedro
Pereira-Almao
Asphaltene Adsorption on Iron Oxide Surfaces 509
Estrella Rogel, Michael Roye
Molecular Properties of Virgin and Converted Arabian Light Vacuum Residue: 512
Implications on Adsorption and Catalysis
Francisco Lopez-Linares, Mazin Fathi, Lante Carbognani Ortega, Pedro Pereira-Almao, Estrella Rogel,Cesar Ovalles, Ajit Pradhan, John Zintsmaster
On Column Filtration Asphaltene Characterization Methods for the Analysis of 516
Produced Crude Oils and Deposits from Upstream Operations
Estrella Rogel, Cesar Ovalles, Michael Moir
Comparative Compositional Analysis of Untreated and Hydrotreated Oils by 15T 519
Ultrahigh Resolution Atmospheric Pressure Photo Ionization Fourier Transform Ion
Cyclotron Resonance Mass Spectrometry (APPI FT-ICR MS)
Jorge Orrego-Ruiz, Andrea Gomez-Escudero, Martin Mojica-Alarcon, Beatriz Murcia-Celis
Expanding GC Use in Petroleum and Petrochemical Applications 521
Carl Rechsteiner, John Crandall, Ned Roques
Application of NMR Technology in Petroleum Exploration and Characterization 523
Ajit Pradhan, Boqin Sun, Zheng (Elton) Yang, John Zintsmaster
UNDERSTANDING THE MOLECULAR INFORMATION CONTAINED IN THE INFRARED 525
SPECTRA OF COLOMBIAN VACUUM RESIDUA BY CHEMOMETRICS
Jorge Orrego-Ruiz, Alexander Guzman, Enrique Mejia-Ospino, Daniel Molina
Evaluation of Atmospheric Pressure Gas Chromatography Tandem Mass 528
Spectrometry (APGC/MS/MS) for Petroleum Biomarkers Analysis
Chang Hsu, Quan Shi, Douglas Stevens
Advances in field-deployable NMR instruments for laboratory and process 529
applications in the petroleum and petrochemical industries - chemometrics, direct
measurements, and data fusion
John Edwards, Paul Giammatteo, Tal Cohen
Hydrocarbon Resources
Hydrocarbon-Pool Route to Conversion of Biomass Derived Ethanol to 532
Hydrocarbon Blend-Stock
Erik Casbeer, Robert Geiger, Brian Davison, James Szybist, Martin Keller, Chaitanya Narula*
Evaluation of catalyst loading profiles for residue hydrodesulfurization by high 534
throughput experimentation
Kazuhiko Hagiwara, Ryuzo Tanaka, Ryuichiro Iwamoto, Jochen Berg
Design and Testing of a Disclosable Hydraulic Fracturing Fluid 536
Jeremy Holtsclaw, Andrew Jarratt, Mike McCabe
Molecular modeling for hydrodesulfurization and hydrogenation of light gas oil 537
Shogo Teratani, Kazuhiko Hagiwara, Ryuzo Tanaka, Zhen Hou, Craig Bennet, Micheal Klein
Application of the hyphenated technique, Size Exclusion Chromatography - 539
Induced Coupled Plasma Mass Spectrometry (SEC-ICP/MS), for the size distribution
characterization of nickel and vanadium compounds in heavy oil fractions
Jeremie Barbier, Charles-Philippe Lienemann, Joao Marques, Isabelle Merdrignac, Agnes Le Masle,
Didier Espinat
Potentialities of Pulsed EPR spectroscopy in the identification of Vanadyl 541
complexes in asphaltene molecules
Olivier Delpoux, Jeremie Barbier, Karima Ben Tayeb-Meziane, Joao Marques, Jan Verstraete, Herve
Vezin
Detailed compositions and molecular structures analysis using FT-ICR-MS related 544
to slurry phase hydrocracking for heavy oil
Iwane Shiozaki, Ryuzo Tanaka, Teruo Suzuki, Yoshiyuki Hazama, Keita Katano, Shigetaka Fujii,
Motoharu Yasumuro
Theory and Simulation in Energy Production, Storage, and Utilization
Tungsten Oxide in Catalysis and Photocatalysis: Hints from DFT 546
Gianfranco Pacchioni, Cristiana Di Valentin, Fenggong Wang
Reliable Modeling of Bonding for Complex Interfaces with Applications in 547
Catalysis, Molecular Electronics, and Photovoltaics
Alexandre Tkatchenko
PREDICTIVE MODEL FOR DYE SENSISTIZED SOLAR CELLS 548
Wei-Qiao Deng, Lei Sun, Lei Jiang, Bi-Feng He
Fundamental research on catalytic SCW-coal gasification 549
You Han, Xiaoxia Weng, Zhenghua He, Jinli Zhang, Wei Li
Towards realistic first-principles modeling of nanostructures in catalysis and 550
energy technologies
Konstantin Neyman
Doping Ce02 with trivalent cations: Defect structures and reducibility 551
Jeremy Allen, Patrick Keating, David Scanlon, Graeme Watson
Effects of O and C on the adsorption of methanol steam reforming intermediates 554
on PdZn (100)
Rem Jern Lim, Xiang Li, Kok Hwa Lim
Ni/Ce02: A promising catalyst for water-gas shift 556
M. Veronica Ganduglia-Pirovano, Javier Carrasco, David Lopez-Duran, Laura Barrio, Ping Liu, Jose
Rodriguez
Theoretical Understanding of Pd@Pt core-shell nanoparticles 557
Wei An, Ping Liu
Catalytic activity of precious metal clusters: a few good examples 558
Yi Luo
The conversion of C02 and C2H6 to propanoic acid over the Au-exchanged 559
MCM-22 zeolite
Winyoo Sangthong, Bundet Boekfa, Jumras Limtrakul
Theoretical investigation of tungsten oxide bronzes as hydrodeoxygenation 562
catalyts
Francois Amar, Brian Frederick, Timothy Thibodeau, Christopher Goodwin, Daniel Moberg
Computational Studies of Organic Electronic Materials with Density Functional 563
Theory Methods
Qin Wu
GROTTHUSS VS NON-GROTTHUSS CHARGE TRANSPORT IN POLY-IMIDAZOLE 564
MEMBRANES
Carlo Adamo
In Silico Design and Characterization of Dye Sensitizers for Solar Cells 565
Lichang Wang
How well can we do computational heterogeneous catalysis ? - A Caveat ! 566
Xin Xu
Reforming or defunctionalizing of biomass. A DFT study on reactions of model 567
alcohols over platinum
Notker Roesch, Duygu Basaran, Cheng-Chau Chiu, Alexander Genest
9th Symposium on Hydrotreating/Hydrocracking Technologies
Numerical simulations of the slurry bed reactors for residue hydrotreating 568
process
Zhenxing Zhu, Xiaojin Tang, Shuandi Hou
Adsorptive removal of dimethyldisulfide in simulated oil with zeolite adsorbents 569
Yabo Hou, Xingliang Huang
Adsorptive denitrogenation of liquid hydrocarbons on carbon-based adsorbents 571
for ultra-clean fuels: a study on adsorptive selectivity and mechanism
Masoud Almarri, Xiaoliang Ma
Converting a two stage hydrocracker to single stage unit 573
Omar AlZuwaidi, Stanley Gustas III
A High-Energy-Efficiency Hydrocracking Technology and Commercial Application 574
Yanze Du
kinetic Models for assessment of the reaction network in Hydrodesulfurization of 576
Polyaromatic Sulfur-Containing Compounds
Hamdy Farag, Masahiro Kishida
Hydrocracking of Soybean Oil Using Zeolite-Alumina Composite Supported NiMo 579
Catalysts
Atsushi Ishihara, Naoya Fukui, Tadanori Hashimoto, Hiroyuki Nasu
Hydrocracking of Vacuum Gas Oils - Recent Trends in Catalyst Development 581
Gerhard Pirngruber, Lapisardi Gregory, Jeremy Francis, Susana Lopes-Silva, Laurent Simon,
Emmanuelle Guillon
Criterion DC-2635 CoMo CENTERA®: Substantial Activity Improvements Over 583
Broad Application Ranges Through Formulation & Manuafacturing Advancements
Lawrence (Larry) Kraus, John Smegal, Karl Kruger
Kinetic studies and evaluation of nanoporous carbon for desulfurization of fuels 588
coupled with GC- SCD detection method
Khalid Alhooshani, Abdullah Al Swat, Tawfik Saleh, Mohammad Siddiqui
Synthesis of aluminum-modified 3D mesoporous TUD-1 materials and catalytic 590
performance for hydrodesulfurization of FCC diesel
Yunchuan Deng, Aijun Duan, Zhen Zhao, Jian Liu, Guiyuan Jiang, Yuechang Wei, Daowei Gao
Synthesis and application of zeolite W in the catalyst for the hydro-upgrading of 591
FCC gasoline
Huan Niu, Aijun Duan, Zhen Zhao
Synthesis of Zr-Incorporated Beta/SBA-15 Micro-Mesoporous Materials with 592
Platelet Morphology and its Performance for the HDS of FCC Gasoline
Daowei Gao, Aijun Duan, Zhen Zhao, jian Liu, Guiyuan Jiang, Yuechang Wei, Yunchuan Deng,
Tianshu Li, Chao Liu
Hydrotreating of Jatropha Oil on Reduced Nickel-Molybdenum Catalysts 593
Eika Qian, Ning Chen, Shaofeng Gong
Advancement and Economics of CEP Re-refining Technology improved with 596
sophisticated Hydrotreating Technology
Louis Magnabosco, Joshua Park
Stored Award: Symposium in Honor of A. C. Buchanan, III
Surface dependent reactions of CI and C2-alcohols on ceria nanocrystals with 600
define surface facets
Zili Wu, Meijun Li, Amanda Mann, David Mullins, Steven Overbury
Computational Investigation of the Pyrolysis of Oxygen-Substituted Phenethyl 602
Phenyl Ethers
Ariana Beste, Archibald Buchanan
Mechanistic Modeling of the Decomposition of Glucose-Based Carbohydrates: 605
Effect of Sodium Ion
Linda Broadbelt, Xiaowei Zhou, Heather Mayes
PyrolysisKinetics of Anisole and other Simple Lignin Model Compounds 607
Yogesh Koirala, Stephanie Villano, Hans-Heinrich Carstensen, Anthony Dean
High temperature chemistry of aromatic hydrocarbons 609
Lawrence Scott
Catalysts targeting the deoxygenation of lignin for the production of fuels 612
Jason Hicks, Gregory Neumann, Brian Pimentel, Dallas Rensel, Megan Gin
Catalysis of routes from lignin to hydrocarbons in water 614
Donald Camaioni, Johannes Lercher, Chen Zhao, John Fulton, Jianzhi Hu, Donghai Mei
Thermal Decomposition of Biomass Model Compounds in Microtubular Reactors 617
Mark Nimlos, Adam Scheer, David Robichaud, Mark Jarvis, Calvin Mukarakate, Angayle Vasiliou,
Kimberly Urness, Musahid Ahmed, John Stanton, John Daily, Donald David, G. Ellison
Molecular dynamics in mesoporous substrates: lessons from simulation 619
Alan Chaffee, My-Huong Nguyen, Bandar Fadhel
Unraveling complex pyrolysis pathways of lignin model compounds 621
A.C. Buchanan III, Michelle Kidder, Ariana Beste, Phillip Britt
Formation of polycyclic aromatic hydrocarbons from the pyrolysis of plant 624
steroids: The role of steroid structure
Phillip Britt, Michelle Kidder, A. C. Buchanan III
In Situ Catalysis Studies with Small Angle X-ray Scattering 627
Randall Winans, Sungsik Lee, Tao LI, Byeongdu Lee, Soenke Seifert, Justin Notestein, Christian
Canlas
Use of Molecular Beam Mass Spectrometry in the Characterization of 629
Hydrocarbon Materials and Fuel Pyrolysis Kinetics
Andrew Herring, Robert Evans, Matthew Liberatore, J. McKinnon
Fuels, Chemicals, Materials, and Energy from Coal, Natural Gas, Oil
Shale, and Other Natural Resources
METHANE REACTS WITH HETEROPOLYACIDS CHEMISORBED ON SILICA TO 631
PRODUCE ACETIC ACID UNDER SOFT CONDITIONS
Miao Sun, Jizhe Zhang, Jean-Marie Basset
Characterization of Coal Liquids for Refining to Transportation Fuels 633
TOLUWANISE ADESANWO, Moshfiqur Rahman, Arno Klerk, Rajender Gupta
Visbreaking oil sands bitumen at 400 °C 635
Lin Wang, Shaofeng Yang, Vinay Prasad, Arno de Klerk
Systematic advanced NMR techniques for characterizing oil shale, its isolates, 638
and residues after retorting
Jingdong Mao, Xiaoyan Cao, Justin Birdwell
Tortuous migration pathway and gas production behavior of Barnett shale 641
Qinhong Hu, Zhiye Gao, Robert Ewing
Production of high-grade carbonaceous materials and fuel having similar 643
chemical and physical properties from low grade carbonaceous resources by degradtive
solvent eatraction
Kouichi Miura, Ryuichi Ashida, Janewit Wannapeera, Nakom Worasuwannarak
FAST PYROLYSIS OF NINGGUO WALNUT SHELL: EFFECTS OF PYROLYSIS 645
TEMPERATURE AND REACTION TIME
Yixin Chen, Xifeng Zhu
Combined steam and carbon dioxide reforming of methane and natural gas at 647
high pressures: Bi-reforming
Alain Goeppert, Miklos Czaun, Robert May, Surya Prakash, George Olah
Continuous and Prolonged Oxidation of Bitumen for Upgrading by Microbial 649
Digestion
Muhammad Siddiquee, Arno de Klerk
Effect of ytria addition to alumina supported rhodium catalysts on the partial 652
oxidation and autothermal reforming of methane.
Fabio Passos, Vanessa Ribeiro, Maisa Cunha, Ana Coutinho
Gd promoted Ni-ZSM-5 catalyst for carbon dioxide reforming of methane 654
Rajaram Bal
Molecular weight parameters of oil shale pyrolysis products 656
Vahur Oja
Geochemistry of Coalbed Methane Natural Gas Produced Water 658
KJ. Reddy
Solution combustion synthesized catalytic materials for oxidative coupling of 660
methane
Ranjita Ghose, Hyun Tae Hwang, Arvind Varma
Promotion effect of Ce on Ni/Si02 catalysts in the autothermal reforming of 662
methane with C02 and 02
Baitao LI, Shuyi Zhang, Xiujun Wang
Dynamic separation of ultradilute C02 with a nanoporous amine-based sorbent 664
Leilei He, Maohong Fan, Bryce Dutchera, Sheng Cuib, Xiao-dong Shen, Yong Kong, Armistead G.
Russell, Patrick McCurdy, Yulong Zhang
Synthetic Fuels Production with Compact Heat Exchange Reactors 665
Yulong Zhang, Vijay Sethi
Kerogen Locking in Oil Shale 666
Kalpana S. Katti, Dinesh R. Katti, Him Upadhyay
Effects of composite iron-sodium catalysts on coal gasification 667
Rodolfo Monterroso, Maohong Fan, Fan Zhang, Ying Gao, Tiberiu Popa, Morris D. Argyle, Brian
Towlera
Review of recent advances in carbon dioxide separation and capture 668
Saeed Danaei Kenarsari, Maohong Fan
Catalytic performances and in-situ surface chemistries of ceria doped with 669
palladium, platinum and rhodium in methane partial oxidation for production of syngas
Franklin (Feng) Tao
Recent Progress of Coal Chemical Technologies in China 670
Qi Sun