CHEDMonday, April 7, 2008

2:00 PM-4:00 PM Morial Convention Center -- Hall A, Poster
Undergraduate Research Poster Session: Physical Chemistry
Organizer:Nancy Bakowski
Absorption properties of porphyrin functionalized single wall carbon nanotubes
Alexander R. Csengery, Russ Selzer
Adsorption and decomposition of sarin on zinc oxide surfaces
Jonathan P. Olson, Michael J. Dorko
Analysis of liquid methanol-d3 by Raman spectroscopy and density functional calculations
Tegan S. Presley, Daniel M. Besemann
Application of a kink-based path integral formulation to molecular systems
Shawn L. Wilkinson, Randall W. Hall
Application of a 2-D particle in a box model to the electronic absorption spectra of polyaromatic hydrocarbons and porphyrin molecules
David L. Sellers, Jenna L. Manby, Thomas S. Kuntzleman
Application of clay supported Gemini surfactants in triphase catalysis
Nahid Shabestary, Timi J. Parker, Neha H. Parikh
Atomistic simulations of carbon dioxide and nitrogen: Adsorption and diffusion in zeolites
David Selassie, Felix Amankona-Diawuo, Daniela Kohen
Calculation of equilibrium self-assembly constant of 2-amidopyrimidine
James P. Barnett, Nicholas Root, Christopher S. Mello, Nolan Schmidt, K. Wade Elliott, Jeffrey N Woodford
Calculation of van der Waals forces
Anna N. Bloom, Paul D. Schettler
Cancer drug design: Long range communications in cytoskeleton proteins
Farhana Momin, Ruxandra I. Dima
Characterization of thin metal film growth on an organic self-assembled-monolayer using current-sensing atomic force microscopy
Sean E. Keuleyan, Yangjun Xing, Jacqueline Hines, Eric Borguet
Charge transfer interactions in complexes formed by carbon60 fullerene and derivatives of calix[4]arene
Kathryn Lukhart, Karl Zachary
Chemical synthesis induced by dissociative electron attachment
Lin Zhu, Mahesh Rajappan, Chris Arumainayagam, Andrew Bass, Leon Sanche
“Coloring problem” for γ-brasses: Cu9-xAl4+x
Ruth B. Cink, Gordon J. Miller
Combating nuisance alarms caused by the “ship effect” in helium 3 based neutron detection radiation portal monitors
Anna F Oliveri, Elise Buckley, James Borgardt, Richard T. Kouzes, Allen Seifert, Edward R. Siciliano, Lindsay Windsor
Combined ab initio and Monte Carlo study of hydrogen bonding in the crystalline cellulose structure
Timothy F. Cunningham, Ronald C. Brown
Comparison of NMR analysis to HPLC method following the degradation of creatine monohydrate in various formulations
Kiyana Edwards, Jeavon Inniss, Tony Wallner
Competition between trans-cis isomerization vs. [2+2] addition in cocrystals of sorbic acid and 1, 1, 6, 6-tetrahexaphenyl-2, 4-diyne-1, 6-diol
Oanh H. Pham, S-L. Zheng, Philip Coppens, Milan Gembicky
Computation of the pKa values of some neutral molecules and anions in aqueous solution
Daqing Gao, Yinjuan Cui, Ermir Pjetri, Anibal Davalos, Eza Chikashvili, Jessica Lenis
Computational analysis of the solubilization of single-walled carbon nanotubes by reversible cyclic peptides
Marie C. Maher, Chi-cheng Chiu, Gregg R. Dieckmann, Steven O. Nielsen
Computational analysis of the through-bond interactions of electronegative atoms
Taylor Arnold Barnes, Preston J. MacDougall
Computational approaches to investigate hydrogen bonding and base stacking for A-U, G-U, and I-U pairs
Praneetha Thulasi, Michael Lewis, Brent M. Znosko
Computational characterization of LuSb to determine k-space orientation
Teresa M. J. Beary, Yongbin Lee, Bruce Harmon
Computational chemistry studies of caprolactam in various solvation environments
Kaely Aikman, Nancy E. Breen
Computational study of diazonaphthalene conformers
Rebecca L. Klug, Rudolf Burcl
Computational study of nitric oxide cation cluster thermodynamics
Kevin M. McLendon, Sydney H. Ryan, Alan C. Goren
Computational study of the counterion and solvent effect on stereoselectivity in SN2 reactions of cyclic nitrile anions
Lisa N. Morkowchuk, Jeffry D. Madura
Computational study of the phenol-formaldehyde reaction: Reactive intermediates and transition states with solvation
Julaunica A. Tigner, Melissa S. Reeves
Computational study on the heats of formation of phenylpyrazines
Michelle Ann Thornhill, Michael R. Salazar
Constructing the phase diagram of water and n-octyl-β-D-thioglucoside by fluorescence spectroscopy
Kristen N. Chellis, Kerry K. Karukstis, Gerald R. Van Hecke
Paper Withdrawn
Determination of the binary phase diagram of n-decyl-β-D-glucoside in water
Alison R. Lee, Christina A. Snyder, Gerald R. Van Hecke, Kerry K. Karukstis
Developing a mathematical model of lipid titrations
Bradley David Towey, Thomas G. Anderson
DFT studies of Cu clusters
Chasity B. Love, Lichang Wang
Dynamical simulations of solutes in nanoconfined acetonitrile
Cassandra Norton, Ward H. Thompson
Dynamics of small molecules complexed with calixarenes: Toward an understanding of organic solid state porosity
Jack R. Cox, Andrew J. Christiano, Carol A. Deakyne, John E. Adams
Effect of capping agent on cyclohexanone hydrogenation using colloidal Pt nanocatalysts
Kimberly A. Manbeck, Carrie A. Kauffman, Jason K. Navin, Anderson L. Marsh
Effect of high concentration collagen type I on matrix induced glioma expansion and migration
Christian Gluck, Cheng Guo, Laura J. Kaufman
Effects of the porphyrin oxidation state on the conformations of c-type cytochromes
Tim L. Vuong, Kristy L. Mardis, David M. Tiede
EPR study of spin-labels in aqueous inclusions within macrosteps of KHP and phthalic acid single crystals
Lev Ryzhkov, Paul C. Norris, Tanyka Young
Examination of cooperative effects in π-stacking
Macey L. Renault, Gregory S. Tschumper
Examining the unconventional bonding in borohydrides via valency interaction formulas
Bess Vlaisavljevich, Joseph D. Alia
Excess thermodynamic functions of alcohol+n-alkane mixtures using viscometry, dilatometery, refractometry, and laser light scattering
Minseok Jang, Gerald R. Van Hecke
Fluorescence quenching of pyrromethene 546
Amanda Hixon, Joseph M. Brom
Guest-host chemistry of p-sulfonatocalix[6]arene with guanadinium containing guests
Shehan L. Don Talagala, Thomas W. Shattuck, Peter D. Foster, Cassandra L. Newell
Heat capacity and spectra of deep eutectic solutions
Stephen A. Fordham, Jan Gryko
High resolution photoelectron spectroscopy of Li-pyridazine
Anthony James Michael Imberi, Serge Krasnokutski, Dong-Sheng Yang
Infrared pump-probe investigation of melanin vibrational relaxations
Aaron Massari, Sarah A. Weinreis, Audrey A. Eigner
Investigating single and multicomponent phase coexistence and nucleation properties for some simple models: From charged hard dumbbells to Lennard-Jones mixtures
Michael DeLee, Lawrence J. Tauzin, Samuel J. Keasler, Ricky B. Nellas, Bin Chen
Investigating the behavior of catanionic surfactant Langmuir monolayers
Joseph D. Coppock, Brian G. Moore, Mike Dennin
Investigating the photophysical properties of sunscreen active ingredients
Andrew C. Rudawsky, Sarah J. Schmidtke
Investigation of cell endocytosis of polyeletrolyte multilayer microcapsules
Krithika Kavanoor, Zhihua An, Laura J. Kaufman
Investigation of dimethyl ether as an initiator in the conversion of methanol to gasoline process using H-ZSM-5
William M. Aumiller Jr., Paul D. Schettler Jr.
Investigation of HCFCs through computational and experimental methods
Amanda L. Steber, Rebecca A. Peebles
Investigation of pyrromethene dyes in the presence of quinones by transient absorption spectroscopy
Nathaniel C. Brandt, Joseph M. Brom
Investigations of nonequilibrium antifreeze activity of synthetic antifreeze polypeptides
Camden N. Henderson, Charles A. Knight, Andrzej Wierzbicki
Investigations of the photophysical properties of sunscreen active ingredients
Rachel E. Lipner, Brandi Michelle Baughman, Sarah J. Schmidtke
Iodine in clathrate hydrate cages
Reid K. Smith, Lisa B. Lewis
Ionic association in varied solvents with different dielectric constants
Jill P. Williamson, Renee Cole, Roger Frech
Luminescent properties of nitrogen-donor metal coordination polymers
Brittany L. Serke, Yu-Fong Yen
Matrix isolation study of the ozonolysis of cis-2-butene
Mary Clay, Bruce A. Ault, Michael Hoops
Measuring the heat of combustion of regular potato chips, reduced fat potato chips and nonfat potato chips using bomb calorimetry
Paul Giokas, John B. Dudek
Metastable fragmentation and photodissociation of sulfur-containing molecular cluster ions
Luke A. Erickson, David A. Hales
Methane to methanol conversion on vanadium and niobium oxide clusters
Stephanie M. Braun, Adam D. Arnold, Eric D. Glendening
Methane-to-methanol conversion on first-row transition metal oxide cations
William J. Jackson, Tyler M. Fromm, Eric D. Glendening
Mixed quantum/classical studies of Trypanosoma cruzi's trans-sialidase
Jason M. Swails, Özlem Demir, Gustavo de M. Seabra, Adrian E. Roitberg
Modeling acidic water clusters using EFPs
Kurt R. Brorsen, Jonathan M. Mullin, Mark S. Gordon
Modeling the 13C chemical shift tensors of organic single crystals by density field theory
Jessica C. Johnston, Robbie J. Iuliucci
Molecular dynamics simulations of surfactant protein C mimic in phospholipid bilayers
Wesley M. Smith, Stephen M. Dutz, Patrick W. Mobley, Larry M. Gordon, Frans J. Walther, Alan J. Waring, Shantanu Sharma
New molecular architectures toward highly efficient platinum doped titanium dioxide photocatalysts
Frank A. Leibfarth, Ranjit Koodali
NMR relaxation studies of hydrogen bonding in simple amide compounds
Tiffany E. Muns, Nancy E. Breen
Noncovalent interactions of azo dyes with anionic surfactant micelles
Jonathan P. Litz, Matthew Garber, Kerry K. Karukstis
Nonideality in the binary phase diagrams of homologous 4'-n-alkyl-4-cyanobiphenyls
Joshua M. Cobb, Gerald R. Van Hecke
On the heat of formation of nitromethane
Patrick H. Willoughby, John A. Bumpus
Oxidation of phenethyl alcohol via triphase catalysis using clay supported Gemini surfactants
Nahid Shabestary, Neha H. Parikh, Timi J. Parker
Pd/Cu alumina catalyst for nitrate reduction
Stephanie L. Skiles, Joel E. Boyd
Perilous vibrations of tetraazidomethane
James Hinshaw, Lucas Speakman, Henry F Schaefer III
Photoinduced electron transfer across reverse micelle interfaces using anthracene and ferric cyanide
Sheneve Butler, Ruth E. Riter
Probing new theories of hydrocarbon stability with computational quantum chemistry
Joel L. Mackey, Carl R. Kemnitz
Probing pH effects on oligomerization of Alzheimer's amyloid-ß peptide by single-molecule spectroscopy
Kyle Dukes, Cassie Rodenberg, Robin Lammi
Pyro-electric crystal particle accelerator
Chelsea L. Harris, Rand Watson
Reaction kinetics of the oxidation of o-phenylenediamine with ammonium persulfate
Erik W. Hobbs, Edward G. Hohenstein, James R. Locker
Reactions of Cu+(1S, 3D) with CF3X (X=Cl, Br, I)
Scott R. Musial, William S. Taylor, Micah L. Abrams
Reduced methylated guanidinium radical
Edward M. Barbieri, Margaret Mandziuk
Paper Withdrawn
Simulating a relaxation mechanism for UV-excited 9H-Adenine
Christopher E. Schlosberg, Hanneli Hudock, Todd J. Martinez
Paper Withdrawn
Solid-state NMR studies in model coal compounds
Cody L. Hoop, Robbie J. Iuliucci
Spectrophotometric studies of complexes formed by cucurbit[7]uril with organic dyes
Abigail Turner, Karl Zachary
Storage of methane gas in propane hydrate
Yazmin Lee Cazares
Structures and energies of water on graphite surface with functional groups: As seen using Gaussian 98
Lauryn R. Wolfe, Joshua Samuel
Study of organic dyes used in organic dye sensitized solar cells (DSSC): Application in computational chemistry
J. W. Kreft, S. J. Mo
Study of the disorder to order transitions of disubstituted naphthalenes
Sean M. Ryland, Kenneth A. Martin
Studying the 1,5-hydrogen shift in 1,3-pentadiene and 1,7-hydrogen shift in 1,3,5-heptatriene via valency interaction formulas
Bess Vlaisavljevich, Ching-Wen Hsu, Joseph D. Alia
Surface chemistry of benzene, acetylene and ethylene on porous glass
Matthew D. Graaf, Shoshanna R. Coon
Surface tension measurements of alkali halide salts dissolved in ethylene glycol
Yannika C. Marrs, Maria J. Krisch, Steven Baldelli, John C. Hemminger
Surface-enhanced Raman scattering of p−nitrobenzoic acid on Ag-Au alloy nanoparticle surfaces
Evan A. Hiles, Rachel K. Kaneta, Brian D. Gilbert
Surface-enhanced Raman scattering of p-nitrobenzoic acid on Ag-coated Au nanoparticle surfaces
Rachel K. Kaneta, Evan A. Hiles, Brian D. Gilbert
Surface-enhanced Raman spectroscopy of p-(dimethyl)amino-cinnamaldehyde on colloidal silver
Diane Morgan, Brian D. Gilbert
Synthesis of quantum dots and their potential applications in the field of forensic science
Kimberly A. Hoffman, Michael D. Schuder
Systematic study of structure and physical properties of smectogenic 2,7-diacylfluorenes
Colleen E. Small, Aurora A. Pribram-Jones, Rachel N. Harris, Kimberly A. Dallas, Lucas Baker, Gerald R. Van Hecke
Theoretical investigations of C2O4
Michael Howart, Jie Song
Theoretical investigations of nickel dicarbide
Brendan L. Yonke, Michael Howart, Jie Song
Thermal stability of hydrocarbon monolayers on porous silicon
Andrew N. Simonson Sr., Robert S. Cunningham, Shoshanna R. Coon
Thermodynamic determinations for Cu2+ binding by amyloid-β peptides through mutation studies
Tessa M. Carducci, William D. Bush, Lanying Q. Hatcher, Lian Hong, John D. Simon
Thermodynamic properties of amino acids
Alissa A. Gadpaille, Benjamin P. Huddle
Use of a Raman microscope to obtain useful SERS signals with colloidal gold
Daniel J. Hibbard, Paul H. Davis
Use of pressure perturbation calorimetry to study the guest-host chemistry of calixarene with guanidinium- and amine-containing guests
Cassandra L. Newell, Thomas W. Shattuck, Peter D. Foster, Shehan L. Don Talagala
Using a genetic algorithm to simulate hydrocarbon and hydrosilicon structures
Charles Rareshide, Kai-Ming Ho
Using crystal structure analysis to determine the structure of indole-6-carboxylic acid
Steven A. Blubaugh, Allison J. Long
Using wide-angle X-ray scattering profiles to evaluate the CHARMM forcefield ensembles of common solvents
Adrienne Eastland, Heather Sutton, Kristy L. Mardis, David M. Tiede
V(CO)7+: A capped octahedral structure completes the 18-electron rule
Jay W. Dicke, Henry F. Schaefer III, Nathan J. Stibrich
Vibrational averaging of chemical shielding for self-assembling molecules
K. Wade Elliott, Jeffrey N Woodford

Symposium Grid -- Division of Chemical Education -- Session Listing

The 235th ACS National Meeting, New Orleans, LA, April 6-10, 2008