The Ole Miss Physical chemistry Research Program seeks applicants for a summer Research Experience for Undergraduates (REU) program funded by CHE-1156713, CHE-1460568, CHE-1757888 and CHE-2150352. Ten non-University of Mississippi students who have completed their freshman year of college and who have not yet graduated can participate fully in the Ole Miss Physical Chemistry Research Program activities and work on a research project under the direction of a faculty advisor. External (non-UM) student participants will receive a $6,000 stipend, a housing and meal plan for ten weeks, and travel assistance. Undergraduate student participants must be citizens or permanent residents of the United States or its possessions. For more information, contact program director Dr. Nathan I. Hammer at nhammer@olemiss.edu. Click on "Faculty" on the menu bar for a list of participating faculty and click on "Example Research Projects" to the right for example research projects.
The Hammer Research Group studies the fundamental physical properties of interacting biologically-relevant building blocks and newly-developed nanoscale molecular systems using laser-based vibrational and electronic spectroscopies. Their central goal is to help model these complex systems through comparison of experimental spectroscopic observables to the results of theoretical predictions. To accomplish this goal, members of the Hammer Research Group work closely with theoretical and synthetic collaborators in the design and study of these systems. REU students will work alongside Prof. Hammer and his current graduate and undergraduate students in established NSF-funded research areas but will have their own unique projects to be completed by the end of the summer. Each summer, one student will study the fundamental spectroscopic properties of an important biological building block interacting with water and the other student will study the fundamental properties of newly-developed materials that either have unique emissive or architectural properties. Both projects will be collaborative in nature with computational mentoring from either co-PI Prof. Gregory Tschumper or senior personnel Prof. Robert Doerksen. In the first project, the student will employ Raman and SERS spectroscopies to study a biological building block or biologically relevant small molecule (we have been studying TMAO and pyrimidine most recently) and its interactions with water (as shown in the figure) or other solvents. This student will then simulate the properties of the interacting system and its vibrational frequencies using the quantum mechanical packages learned as part of the REU program. In the second project, the student will study the photophysical properties of newly-developed emissive materials using laser-based Raman, fluorescence, and single molecule spectroscopies. As in the first project, the student will compare their experimental results to theoretical predictions. Prof. Hammer is currently working with a number of synthetic collaborators, including senior personnel Prof. T. Keith Hollis, Prof. Daniell Mattern (Ole Miss), Prof. Gary Gray (University of Alabama-Birmingham), and Prof. Hemali Rathnayake (Western Kentucky University). The specific system under study will change year to year. These two projects have proven to be extremely successful for researchers over the past three years in the Hammer Research Group with a number of resulting publications, including two with undergraduates appearing as first author. Both students will receive laser safety training and will be under the direct supervision of Prof. Hammer.
The Tanner Lab works at the interface of physical chemistry and bioengineering, using a physical chemistry toolkit to tackle biomedical problems. Of particular interest is nanoparticle drug delivery, where fragile or toxic pharmaceuticals are packaged inside nanoparticles before being injected into the bloodstream. However, the vast majority (>99%) of the injected nanoparticles do not reach their intended destination, which hampers their clinical progress. The Tanner Lab develops ionic liquids, which consist of biocompatible anions and bulky cations that are liquid less than 100 °C, to coat the nanoparticle surfaces and modulate the interactions between the nanoparticle and the body. As an example, they discovered that certain ionic liquids are able to hitchhike onto red blood cells in situ, and are now working to understand the chemistry of that interaction. REU participants who join the Tanner Lab will work within a collaborative, diverse, and interdisciplinary environment to investigate biochemical interactions at the nanoscale. They will learn how to design and synthesize ionic liquids, create and coat nanoparticles, and investigate their interactions with biomaterials such as blood, mucus, and skin. They will gain new perspectives on the vital role physical chemistry plays in understanding the human body.
Undergraduate students working with Dr. Fortenberry and his group will get the opportunity to explore molecular structures uncommon under terrestrial conditions and compute accurate spectral data for their detection in support of the Stratospheric Observatory for Infrared Astronomy or the upcoming James Webb Space Telescope. Most of the carbon in the Universe is either tied up in carbon monoxide or polycyclic aromatic hydrocarbons (PAHs). Hence, the rest of the astrochemists’ periodic table is providing motivation for exploration of molecules rarely examined previously or those that are completely new to science. These can include noble gas molecules from potentially the age of the Universe before stars formed; inorganic species that may be constituents of larger crystals and rocks showing up during the formation or destruction of rocky planets; radicals, anions, or cations that are perpetuated in cold molecular clouds; or even PAHs present in nearly every astrophysical region. Once viable molecular candidates are chosen from these sets, accurate anharmonic vibrational frequencies and spectroscopic constants are computed such that observatories can examine the heavens for their possible existence.
The Boyd Research Group focuses on chemical education and environmental chemistry. Specific topics and techniques will vary yearly however, REU students will explore topics such as such as student perception of real-world relevance of physical chemistry topics such as quantum mechanics, the design and implementation of engaged learning activities (e.g., virtual reality, research experiences, place-based learning) into physical chemistry, and recruitment and retention within chemistry. REU students working with Boyd will be exposed to both quantitative and qualitative analysis techniques. Environmental studies may include trace metal analysis of samples collected in Mississippi exposure to students of a variety of spectroscopic techniques.
The Wadkins Research Group studies the structures and properties of large biologically relevant molecules both theoretically and experimentally. One long-term project involves modeling the structure of novel nanomaterial/RNA complexes that incorporate novel RAFT polymers. This is a collaborative project involving faculty members from three universities (Ole Miss, University of Mississippi Medical Center in Jackson, and the University of Southern Mississippi). These new hybrid nanomaterials developed at USM have been shown to have the requisite properties necessary for cell delivery. Prof. Wadkins will host one REU student in his laboratories per summer to study the properties of these new nanomaterials theoretically. The entire research project is directed at mediating the strength of copolymer/siRNA complexes in order to enhance siRNA release within the cell and eventually lead to superior gene knockdown. The experimental data generated is being utilized to develop computational models and methods for this new class of nanomaterial. Developing models of this system is challenging because the RNA itself is extremely large, and a single RAFT polymer has thousands of atoms as well. To make the modeling problem computationally feasible, the Wadkins Group is employing a technique referred to as “coarse-graining” to reduce the all-atom models to smaller, more tractable models as illustrated in the figure below. The Wadkins Group has already developed the coarse-grain model for the siRNA and the all-atom model of a polymer is now working on coarse-graining the carrier polymer. However, the carrier polymers are not homogeneous in composition, and hence statistical distribution simulations are being performed with the RAFT polymers to determine how the heterogeneity of the polymers affects siRNA binding and release. The REU student each summer will analyze computationally how differing polymer compositions result in different RAFT polymer structures, and how each of these interact with siRNA. In future years, the composition of the nanomaterials will evolve with new synthetic developments at USM.
The Doerksen Research Group uses computational methods to study natural products. New natural product molecules often are highly flexible (many rotatable single bonds) and generally contain asymmetric carbons. It can be difficult to determine the absolute configuration (AC) of such a molecule; yet it is important to do so since the AC defines the molecule precisely, and hence is useful for identification, in planning for total synthesis of the molecule, and for understanding the mechanism of action of the molecule as it interacts with chiral protein targets. X-ray crystallography can be used to help determine the AC, but it is often impossible to crystallize the molecule. Methods that involve degradation of the molecule, such as the use of Mosher’s ester, are not generally applicable because typically novel natural product molecules are available in miniscule quantities of a few milligrams at most. A solution is to combine spectroscopic analysis of the molecule with accurate ab initio calculations of properties of the molecule that define the response of a molecule to applied polarized light. The optical rotation (OR) and electronic or vibrational circular dichroism (ECD or VCD) experimental data for the natural product can be compared to the calculated data for one or more particular diastereomers of the natural product in order to aid assignment of the AC. Students in Prof. Doerksen’s research group will learn how to do ab initio calculations (as part of the REU training) and perform calculations, including conformational search, to assist the assignment of the absolute configuration for one or more novel natural product molecules discovered by Doerksen’s collaborators in the National Center for Natural Products Research (NCNPR). Such efforts in the Doerksen lab have led to a series of recent papers on AC assignment.
Inspired by hydrogenase and CO-dehydrogenase enzymes the Chakraborty Research Group develops artificial metalloenzymes for electrocatalytic hydrogen evolution and CO2 reduction. Metalloenzymes represent some of the best known inorganic catalysts in nature, catalyzing difficult reactions with exceptional efficiency and selectivity. Employing rational protein design and synthetic inorganic chemistry, the selectivity of protein scaffolds is merged with the versatility of inorganic catalysts to design unique biocatalysts for selective and efficient transformations relevant to alternate energy. REU students in this project will gain experience in a wide range of chemistry skills including rational protein design, inorganic synthesis, protein expression and purification, conjugation chemistry, chromatography, UV-visible spectroscopy, circular dichroism spectroscopy, electrochemistry, and catalysis.
The Ritchie Research Group studies ionic conductivity in H+ ion conducting Fuel Cell electrolytes. Finding new polymeric fuel cell electrolytes is critical to commercializing fuel cells, especially with electrolytes that can conduct H+ ions at temperatures above 120°C. They are currently working to understand how the structure of polymer electrolytes affect the movement of H+ ions (i.e. the mechanism of ionic transport) in the polymer. REU students will synthesize new polymers, use electrochemical techniques to measure their ionic conductivity and the activation barrier to ionic conductivity, and use polymer characterization and rheometry techniques to measure viscosity as a function of the free volume of the polymers. They will also make different high free volume siloxane POSS Cubes with different polymer "tails" to see how the free volume in the tails affect the ionic transport properties. POSS cubes are a well-defined structure that makes comparison between polymers with different side chains easier. Students will prepare PEG-based and PPG-based (polymer)8T8 POSS cube polymers.
The Cizdziel Group uses microspectroscopy to characterize microplastic (MP) pollution in environmental and biological samples. They develop and apply novel analytical methods to collect, extract, concentrate, detect, and identify microplastics from natural water, air, and biota. The goal is to assess sizes, shapes, and chemical composition of the microplastics to better understand the physicochemical properties, distribution, types, and sources of MPs in the environment and the threat they may pose to both ecosystems and human health. Microplastics are a diverse suite of contaminants consisting of small (less than 5 mm) pieces of synthetic polymers. The different sizes and types of microplastics (and plastic additives) influence their transport, fate, and effects. The ubiquity of microplastics in aquatic ecosystems is of great concern because plastics are persistent, can adsorb toxic chemicals, and are consumed by organisms. These concerns are reflected in the ever-increasing number of papers on microplastics (<500 in 2010 to >5000 in 2020). Students in the Cizdziel group train on advanced chemical instrumentation and conduct exciting research on an emerging global issue, better preparing them for the next steps in their career.
Chemistry in the Jurss Research Group focuses on developing and understanding new earth-abundant transition metal catalysts for reactions relevant to global energy concerns. Energy consumption continues to climb with economic growth and an increasing global population. One of the best candidates for creating a sustainable, carbon-neutral energy economy is sunlight. Artificial photosynthesis aims to store solar energy in the chemical bonds of renewable fuels, such as H2 and CH4, by coupling water oxidation to reductive half reactions (e.g. carbon dioxide reduction). To effectively utilize carbon dioxide and water, better catalysts are needed to mediate these challenging multielectron reactions. Our strategy for converting CO2 and H2O into energy-rich chemical fuels involves the rational design of molecular catalysts with redox-active and/or dinucleating ligands, which enable access to multiple redox equivalents at modest potentials and cooperative bimetallic pathways, respectively. Pendant functional groups in the second-coordination sphere will also be incorporated into catalysts to stabilize intermediates and enhance reactivity. REU students in the Jurss Lab will be involved in the synthesis and investigation of innovative catalysts for renewable energy applications. Electrochemistry and a suite of spectroscopic techniques (NMR, UV-Vis, FTIR, fluorescence, spectroelectrochemistry) will be employed to examine these systems. Raman and transient absorption spectroscopies will also be used in collaboration with the Hammer Group to study the electronic structure, photophysical properties, and reaction mechanisms of these systems.
The primary research thrust in the Li Research Group is the development of molecular nanographenes, which are discrete, structurally precise cut-outs of graphene sheets. These nanocarbon materials, possessing desirable physical properties that are highly tunable through chemical modification, are of great importance for applications in electronics, catalysis and biomedicine. REU students joining the Li group will employ physical organic and supramolecular principles to innovate nanographenes with unique optoelectronic, magnetic, and recognition behaviors for organic electronics and analyte sensing. Alongside traditional benchtop solution-phase chemistry, we are developing solid-state mechanochemical synthesis, a sustainable and efficient method that harnesses mechanical force to drive chemical transformations. Students working with prof. Li on this project will receive hands-on training on organic synthesis as well as materials characterization techniques including NMR, UV-Vis-NIR spectroscopy, cyclic voltammetry, X-ray crystallography and size exclusion chromatography.
The Lou Research Group leverages organic chemistry to develop peptide-based materials for biomedical applications and to address the challenges in the field of nanomedicine. The emerging fields of nanomedicine and biomaterials have the potential to significantly impact human health by improving the diagnosis, prevention, and treatment of diseases. Despite their promise in cancer theranostics, nanomedicines face limitations in deep tumor penetration due to their nanoscale size. Conversely, small molecule drugs exhibit excellent deep penetration features, but are often easily leaked out or expelled from tumor tissues. Therefore, finding a balance between deep tumor penetration and effective tumor-specific accumulation of nanomaterials represents a critical scientific challenge in anticancer drug delivery. REU students joining the Lou lab will engage in projects focused on an in situ self-assembly approach to address this issue. This method involves exogenous low molecular weight molecules spontaneously forming sophisticated nanostructures with distinct biological functions in response to specific physiological and pathological conditions. These nanostructures accumulate and persist at the pathology site, enhancing their efficacy. REU students in the Lou Lab will receive training in various areas, including synthetic organic techniques, instrumentation (NMR spectroscopy, mass spectrometry, UV-Vis, IR, etc.), nanomaterial construction and characterization, and cell-related assays. This comprehensive training will help students expand their career options and prepare them for future scientific endeavors.
The Ray Research Group investigates the intricate workings of biological systems at the nanoscale, with a particular emphasis on cellular stress response mechanisms. Research focuses on examining how specific DNA and RNA structures enable cells to efficiently allocate resources and adapt to challenging environmental conditions by prioritizing crucial functions. They aim to elucidate the complex interactions between these DNA/RNA structures and various proteins, exploring how they collectively manage cellular demands. The goal is to establish clear connections between structural characteristics and functional responses within cells. To achieve these objectives, they develop and implement cutting-edge single-molecule manipulation and detection techniques, as well as nanoscale engineering approaches. Projects are inherently interdisciplinary, combining methodologies from chemistry, physics, molecular biology, and engineering. As an REU participant in the Ray Group, students will gain hands-on experience in developing highly sensitive detection methods for specific DNA/RNA secondary structures using kinetic fingerprinting techniques. Through these projects, students will gain hands-on experience with a range of advanced research methodologies, including: (1) design and automation of single molecule TIRF microscope, (2) design and optimization of nucleic acid probes, (3) application of single-molecule manipulation and detection methods, (4) use of nanoscale engineering techniques and (5) data analysis and interpretation of kinetic fingerprinting results. This experience will not only provide students with valuable technical skills but also contribute to the broader understanding of cellular stress response mechanisms at the molecular level. By developing more sensitive and specific detection methods for DNA/RNA secondary structures, researchers can gain deeper insights into how these structures interact with proteins and help cells manage resources under stress conditions at the molecular level.
Research in the Sundaresan Group focuses on developing and using state-of-the-art electrochemical and optical techniques to study electrochemical phenomena at the nanoscale. Recently, we have developed a new multi-parameter super-resolution optical imaging technique called calcite-assisted localization and kinetics (CLocK) microscopy. This technique enables researchers to obtain the structural anisotropy and orientation of individual nanoparticles by overcoming the fundamental limitations of optical microscopy—the diffraction limit of light. REU students will work on interfacing CLocK microscopy with electrochemical techniques to understand how dynamic changes in the shape of nanoparticle electrocatalysts impact their electrochemical properties. REU students in this project will gain experience in nanoparticle synthesis, various modalities of optical microscopy including CLocK microscopy, electroanalytical techniques such as cyclic voltammetry, amperometry, and scanning electrochemical cell microscopy, as well as image analysis using MATLAB.
REU 2013 Students Funded by CHE-1156713
REU 2014 Students Funded by CHE-1156713
REU 2015 Students Funded by CHE-1156713
REU 2016 Students
REU 2017 Students
External REU 2018 Students
External REU 2019 Students
2021 REU Students
External REU 2022 Students
2022 Internal UM REU Students
External REU 2023 Students
External REU 2024 Students
My time at the Ole Miss Research Experience for Undergraduates was highly rewarding in that I got the opportunity to work on a project which interested me and was able to learn about the world of chemistry research. Even though the experience is designed for and is most helpful for those who are pursuing a graduate degree in chemistry and a career in research, being able to spend the summer working full-time under the direction of a professor and being involved in the research process is an experience that will serve a student interested in a career in science in general extremely well, regardless of what specific discipline the student wants to pursue, or whether the student intends to pursue a career in academic research at all – the skills that are learned from being involved in the research process, such as teamwork, discipline, resilience, attention to detail, critical thinking, and analysis will prove to be useful in a variety of careers that involve science. I was extremely fortunate to have this opportunity, and I would like to thank all of the professors in the Department of Chemistry at Ole Miss, especially Dr. Hammer, the director of this program, and Dr. Wadkins, my advisor who has guided me through the project that I did, for making the REU possible.
I came to Ole Miss with absolutely no chemistry research experience. Although I had greatly enjoyed my classes and laboratory activities at my parent university, we lacked many of the resources needed to conduct meaningful scientific research. I knew that applying my chemical knowledge to real world problems would be significantly more rewarding than memorizing facts from textbooks. Even then, I underestimated the impact of my summer at the University of Mississippi. My Ole Miss REU gifted me the opportunity to interact with several of the brightest minds in biochemistry and pharmacology while simultaneously surrounding me with young adults who are likewise interested in impacting their community through scientific inquiry. Moreover, I can't imagine working with a nicer group of people; the faculty and student researchers are so genuinely kind and encouraging. As an external research student, I never felt like an outsider, and I loved it. I left a little piece of my heart in Oxford, and I now have a better understanding of how exciting a career in research can be.
At the beginning of this summer, I didn't know what to expect- it was going to be my first time going to the South, and I wasn't sure how my experience would go at all, and if I would enjoy my summer at all. Now, I can safely say that I'm so glad that I participated in the Ole Miss PChem REU because the students and faculty made my first Southern experience one to remember. Not only was I able to learn a lot from the research that I did, but I was also able to make friends that I know I will keep in contact with for a while!
Ole Miss REU program was the highlight of my summer. Not only did I learn important technical skills in the lab, I was able to form relationships with other scientists. The program also provided fun activities for us to all bond over and have an awesome time.
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UM Contact Information: titleix@olemiss.edu or 662-915-7045
NSF Contact Information: programcomplaints@nsf.gov or 703-292-8020
Click here for information regarding Sexual Harassment from the National Science Foundation
Welcome to Summer Chemistry Research at the University of Mississippi
The Ole Miss Physical Chemistry Summer Research Program is supported by an NSF Research Experiences for Undergraduates (REU) site (CHE-1156713, CHE-1460568, CHE-1757888, and CHE-2150352), the NSF Experimental Program to Stimulate Competitive Research (EPSCoR), including EPSCoR Track 2 (OIA-1539035) and Track 1 (EPS-0132618, EPS-0903787, and OIA-1757220) awards, and single investigator awards, including NSF CHE-0955550, CHE-0957317, CHE-1455167, CHE-1664998, CHE-1954922 and various NASA and NIH awards. The goals of the program are to:
1. Offer directed research opportunities during the summer to undergraduate students.
2. Provide training in the form of lectures and mini-courses from the faculty.
3. Offer opportunities for students to
learn how design, synthesis, and characterization work together.
4. Allow students (high school, undergraduate, and graduate) to present research talks (20 to 40 min) to a large (50+) peer audience.
5. Develop a student cohort through social activities to help promote
chemistry as a viable career option for undergraduate students.
For more information, click on "NSF REU Site" on the Menu above. To apply for the University of Mississippi NSF REU program, click the link below.
#NSFfunded #NSFREU
Monday | Tuesday | Wednesday | Thursday | Friday |
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May 26 Memorial Day |
27 REU Students Arrive Check into Residence Hall, Pick up ID, Get Parking Pass | 28 Meet in Coulter Hall Room 211 at 9:50am Appropriate Behavior Training in Coulter 200 at 10:00am Social Activity |
29 Lecture by Prof. Ryan Fortenberry Coulter Hall 200 10:00am "Literature Searching Using the UM online Library" Social Activity Chemistry Yoga, Coulter 422 11:30am - 1:00pm |
30 Lecture by Prof. Ryan Fortenberry Coulter Hall 200 10:00am "Astrochemistry" |
June 2 Lecture by Dr. Athena Flint Coulter Hall 200 10:00am "An Introduction to Computational Chemistry" |
3 Lecture by Prof. Vignesh Sundaresan Coulter Hall 200 10:00am "Leveraging Vikings’ Navigation Technique for Single Nanoparticle Studies" |
4 Lecture by Prof. Dan Mattern Coulter Hall 200 10:00am "A Brief History of Scientific Misconduct" Group Picture Coulter 211 11:00am |
5 Lecture by Prof. Penghao Li Coulter Hall 200 10:00am "The art of molecular carbon nanoarchitectures" Social Activity Chemistry Yoga, Coulter 422 11:30am - 1:00pm |
6 Lecture by Dr. C. Zachary Palmer Coulter Hall 200 10:00am "Applications of Computational Chemistry to Astrochemistry" |
9 |
10 Lecture by Prof. Eden Tanner Coulter Hall 200 10:00am "Using Physical Chemistry to Unlock Secrets in Drug Delivery" |
11 Lecture by Prof. Nathan Hammer Coulter Hall 200 10:00am "An Introduction to Spectroscopy" |
12 Lecture by Dr. Claylee Chism Coulter Hall 200 10:00am "Combating Antibiotic Resistance in Septic Infections with Choline-Carboxylate Ionic Liquid Materials as Bacterial Capture Devices" Social Activity Chemistry Yoga, Coulter 422 11:30am - 1:00pm | 13 Lecture by Prof. Sujay Ray Coulter Hall 200 10:00am "Lighting Up Life: From Glowing Dyes to Shining Proteins" |
16 Lecture by Priyavrat Vashisth (Tanner Group) Coulter Hall 200 10:00am "Smart Nanoparticles for Endometriosis: Harnessing Neutrophils and Heat for Targeted Therapy" |
17 Lecture by Prof. Jinchou Lou Coulter Hall 200 10:00am "Responsive Materials and Chemical Tools for Probing Biological Systems" |
18 Lecture by Prof. Jonah Jurss Coulter Hall 200 10:00am "Artificial Photosynthesis: Catalysts for Solar-to-Fuel Conversion Chemistry" |
19 Lecture by Prof. Abby Boyd Coulter Hall 200 10:00am "Topological data analysis as an alternative to machine learning in chemistry" Social Activity Chemistry Yoga, Coulter 422 11:30am - 1:00pm |
20 Lecture by Prof. Ryan Fortenberry Coulter Hall 200 10:00am "Scientists Should Write Like Journalists and Talk Like Cavemen" |
23 |
24 Lecture by Prof. Joshua Sharp Coulter Hall 200 10:00am "Probing Protein-Carbohydrate Interactions Using Mass Spectrometry" |
25 Lecture by Prof. Jason Ritchie Coulter Hall 211 10:00am "Enabling the Hydrogen Economy: New Electrolyte Materials in Fuel Cells and Batteries" |
26 Masters Thesis Seminar by Margaret Stucky (Hammer Group) Coulter Hall 211 10:00am "Halogen and hydrogen bonding interactions with 2,6-dimethoxypyridine" Social Activity Coulter Hall Lobby 11:00am LGBTea |
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30
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July 1 Lecture by Prof. Jim Cizdziel Coulter Hall 211 10:00am "Micro- and Nano-Plastic Pollution: Small Particles, Big Problems?" Reb Researcher Presentations Coulter Hall 211 1:00pm |
2 Lecture by Prof. Steven Davis Coulter Hall 211 11:00am "Energy: Past, Present, and Future" |
3 Social Activity Coulter Hall Lobby 11:00am Chemistry Basketball | 4
Fourth of July Fireworks 9:00pm mTrade Park, Hwy 314 |
7 |
8 Lecture by Katy Howie (Chakraborty Group) Coulter Hall 211 10:00am "Protein Engineering Approaches to Harvest Solar Energy, Catalytic C-H Activation and Battle Cancer" Social Activity Coulter Hall Lobby 11:00am Chemistry Volleyball |
9 Personal Statement Workshop Coulter Hall 211 10:00am |
10 Lecture by Prof. Kensha Clark Coulter Hall 211 10:00am "A Hop, a Skip, and a Jump: Enabling Fast Electron Transfer with Redox Active Ligands" Social Activity TBA |
11 Lecture by Prof. Saumen Chakraborty Coulter Hall 211 10:00am "At the Crossroads of Metals and Biology"
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14 |
15 Lecture by Prof. Nikki Reinemann Coulter Hall 211 10:00am "Motor Proteins: Molecular Drivers of Life and Disease"
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16 Lecture by Prof. Randy Wadkins Coulter Hall 211 10:00am "Biophysics of DNA" Grove Scholars Outreach 2:00pm |
17 Lecture by Prof. Robert Doerksen Coulter Hall 200 10:00am "An Introduction to Computational Medicinal Chemistry" Social Activity |
18 |
21 |
22 Overview of Grad School and Graduate Student Panel Coulter Hall 211 10:00am |
23 INBRE/EPSCOR Conference If Your Mentor is Participating |
24 INBRE/EPSCOR Conference If Your Mentor is Participating Social Activity Chemistry Yoga, Coulter 422 11:30am - 1:00pm |
25 Student Presentations Lecture by Megan McKissick Lecture by Elaina Heath Lecture by Brandon Suh |
28 Student Presentations Lecture by Tauheedah Brady Lecture by Maggie Simmons Lecture by Rita Zhou-Wang Lecture by Michael Harms Lecture by Briana Gamboa |
29 Student Presentations Lecture by Reagan Nichols Lecture by Tyreeanna Thompson Lecture by Camille Kuntz Lecture by Addison Smith Lecture by Drew Martin Lecture by Blake Williamson Lecture by Charlie Earl End of Summer Collaboration Workshop |
30 Student Presentations Lecture by Mira Patel Lecture by Diego A. Martínez Sebastian Lecture by Jakob Liggons Lecture by Isaac Stiles |
31 Student Presentations Lecture by Nathan Moll Lecture by John Cooley Lecture by Lynn Nguyen |
August 1 REU ENDS STUDENTS TRAVEL HOME |
C. M. Sehring, J. A. Johns, V. J. Esposito, and R. C. Fortenberry, “Reparameterized Semiempirical Anharmonic IR Spectra of Neutral PAHs: Benchmarking and Predictions for PAHs with More than Five Rings,” The Journal of Physical Chemistry A, 129, 6623–6631 (2025). (NSF OIA-2150352)
B. S. Olubusoye, J. V. Cizdziel, K. Wontor, R. Li, R. Hambuchen, V. T. Aminone, M. T. Moore, and E. R. Bennett, “Field Evaluation of Rice Husk Biochar and Pine Tree Woodchips for Removal of Tire Wear Particles from Urban Stormwater Runoff in Oxford, Mississippi (USA),” Sustainability, 17, 4080 (2025). (NSF OIA-2150352)
R. R. Cron, J. South, and R. C. Fortenberry, “Quantum Chemical Determination of Molecular Dye Candidates for Non-Invasive Bioimaging ,” Molecules, 29 5860 (2024). (NSF OIA-2150352)
M. E. VanLandingham, R. A. Heintz, C. S. Kariyawasam, D. S. Darlington, C. M. Chism, S. X. Edgecomb, A. Roberts, J. Marzette, N. C. Fitzkee, E. E. L. Tanner, “Ionic Liquid-Modified Nanoparticles as Potential Mucus Modulators for Nasal Drug Delivery,” ACS Applied Nano Materials, 7, 18309–18317 (2024). (NSF OIA-1757888)
C. Curiac, E. C. Lambert, L. A. Hunt, M. Roberts, A. LaMore, A. Peddapuram, H. Cheema, N. I. Hammer, and J. H. Delcamp, “Increasing Photoinduced Interfacial Charge Separation Lifetime Through Control of Twist Angle at the Donor Region of Carbazole-Based Dyes,” Journal of Physical Chemistry C (2023). DOI: 10.1021/acs.jpcc.3c04735 (NSF OIA-1757888)
L. N. Olive, E. V. Dornshuld, H. F. Schaefer III, and G. S. Tschumper, “Competition between Solvent···Solvent and Solvent···Solute Interactions in the Microhydration of the Tetrafluoroborate Anion, BF4–(H2O)n=1,2,3,4,” Journal of Physical Chemistry A, 127, 8806–8820 (2023). DOI: 10.1021/acs.jpca.3c04014 (CHE-1757888)
W. E. Meador, N. P. Liyanage, J. Watson, K. Groenhout, and J. H. Delcamp, “Panchromatic NIR-Absorbing Sensitizers with a Thienopyrazine Auxiliary Acceptor for Dye-Sensitized Solar Cells,” Applied Energy Materials, 6, 5416–5428 (2023). DOI: 10.1021/acsaem.3c00519 (CHE-1757888)
O. G. Haney, B. R. Westbrook, T. J. Santaloci, and R. C. Fortenberry, “Red-Shifting the Excitation Energy of Carbonic Acid Clusters Via Nonminimum Structures,” Journal of Physical Chemistry A, 127, 489–494 (2023). DOI: 10.1021/acs.jpca.2c07589 (CHE-1757888)
M. A. Perkins and G. S. Tschumper, “Characterization of Competing Halogen- and Hydrogen-Bonding Motifs in Simple Mixed Dimers of HCN and HX (X = F, Cl, Br, and I),” Journal of Physical Chemistry A, 126, 3688–3695 (2022). DOI: 10.1021/acs.jpca.2c02041 (CHE-1757888)
D. Nugegoda, S. Bhattacharya, L. A. Hunt, S. J. Schwartz, Z. H. Turner, N. I. Hammer, J. W. Jurss, and J. H,. Delcamp, “Designing Self-Assembled Dye–Redox Shuttle Systems via Interfacial π-Stacking in Dye-Sensitized Solar Cells for Enhanced Low Light Power Conversion,” Energy & Fuels, 36, 7075 (2022). DOI: 10.1021/acs.energyfuels.2c00633 (CHE-1757888)
C. M. Sehring, C. Z. Palmer, B. R. Westbrook, and R. C. Fortenberry, “The spectral features and detectability of small, cyclic silicon carbide clusters,” Frontiers Astronomy and Space Sciences, 9, 1074879 (2022). DOI: 10.3389/fspas.2022.1074879 (CHE-1757888)
M. E. Strauss, T. J. Santaloci, and R. C. Fortenberry, “Valence-, Dipole- and Quadropole-Bound Electronically Excited States of Closed-Shell Anions Formed by Deprotonation of Cyano- and Ethynyl-Disubstituted Polycyclic Aromatic Hydrocarbons,” Chemistry, 4, 42-56 (2022). DOI: 10.3390/chemistry4010004 (CHE-1757888)
D. Grosselin and R. C. Fortenberry, “Formation of Magnesium and Aluminum Oxides from Water and Metal Hydrides: Creation of the Smallest Ruby,” ACS Earth and Space Chemistry, 6, 18-24 (2021). DOI:10.1021/acsearthspacechem.1c00324 (CHE-1757888)
T. J. Santaloci, M. E. Strauss, and R. C. Fortenberry, “Electronically Excited States of Potential Interstellar, Anionic Building Blocks for Astrobiological Nucleic Acids,” Fronteirs in Astronomoy and Space Sciences, 8, 777107 (2021). DOI:10.3389/fspas.2021.777107 (CHE-1757888)
K. N. Poland, C. Z. Palmer, A. Chard, S. R. Davis, and R. C. Fortenberry, “On the Formation and Spectral Signatures of Magnesacyclopropene (c-MgC2H2),” Journal of Molecular Spectroscopy, 382, 111514 (2021). DOI:10.1016/j.jms.2021.111514 (CHE-1757888)
K. R. Barlow, S. M. Goodlett, S. N. Arradondo and G.S. Tschumper, “Fundamental vibrational frequencies of isolated 2-phosphaethynolate and 2-phosphaethynthiolate anions: OCP− and SCP−,” Molecular Physics, e1967495 (2021). DOI: 10.1080/00268976.2021.1967495 (CHE-1757888)
V. K. Shankar, A. Police, P. Pandey, Z. G. Cuny, M. A. Repka, R. J. Doerksen, and S. N. Murthy, “
Optimization of sulfobutyl-ether-β-cyclodextrin levels in oral formulations to enhance progesterone bioavailability,” International Journal of Pharmaceutics 596, 120212 (2021). DOI: 10.1016/j.ijpharm.2021.120212 (CHE-1460568)
H. Shirley, T. M. Sexton, N. P. Liyanage, C. Z. Palmer, L. E. McNamara, N. I. Hammer, G. S. Tschumper, and J. H. Delcamp,“
Effect of “X” Ligands on the Photocatalytic Reduction of CO2 to CO with Re(pyridylNHC-CF3)(CO)3X Complexes, ” European Journal of Inorganic Chemistry, 1844-1851 (2020). DOI: 10.1002/ejic.202000283 (CHE-1757888)
N. Inostroza-Pino, Z. Palmer, T. J. Lee, and R. C.Fortenberry,“
Theoretical rovibrational characterization of the cis/trans-HCSH and H2SC isomers of the known interstellar molecule thioformaldehyde, ” Journal of Molecular Spectroscopy, 369 (2020). DOI: 10.1016/j.jms.2020.111273 (CHE-1757888)
J. Dallas, A. Flint, and R. C. Fortenberry,“
Solvation of HeH+ in neon atoms: Proton-bound complexes of mixed He and Ne, ” Chemical Physics 439, 110927 (2020). DOI: 10.1016/j.chemphys.2020.110927 (CHE-1757888)
T. Sexton, W. Van Benschoten, and G. S. Tschumper, “
Dissociation energy of the HCN⋯HF dimer,” Chemical Physics Letters 748, 137382 (2020). DOI: 10.1016/j.cplett.2020.137382 (CHE-1460568)
A. L. Duddupudi, P. Pandey. H. Vo, C. L. Welsh, R. J. Doerksen, and G. D. Cuny, “
Hypervalent Iodine Mediated Oxidative Cyclization of Acrylamide N-Carbamates to 5,5-Disubstituted Oxazolidine-2,4-diones,” Journal of Organic Chemistry 85, 7549–7557 (2020). DOI: 10.1021/acs.joc.0c00581 (CHE-1460568 & CHE-1757888)
R. C. Fortenberry1, T. Trabelsi, B. R. Westbrook, W. A. Del Rio, and J. S. Francisco, “
Molecular oxygen generation from the reaction of water cations with oxygen atoms,” The Journal of Chemical Physics (2019). DOI: 10.1063/1.5102073 (CHE-1460568)
J. Liu, P. Pandey, X. Wang, K. Adams, X. Qi, J. Chen, H. Sun, Q. Hou, D. Ferreira, R. J. Doerksen, S. Li, and M. T. Hamann, “
Hepatoprotective tetrahydrobenzocyclooctabenzofuranone lignans from Kadsura longipedunculata,” Journal of Natural Products 82, 2842-2851 (2019). DOI: 10.1021/acs.joc.0c00581 (CHE-1460568)
S. N. Johnson, T. L. Ellington, D. T. Ngo, J. L. Nevarez, N. Sparks, A. L. Rheingold, D. L. Watkins, and G. S. Tschumper, “Probing Non-covalent Interactions Driving Molecular Assembly in Organo-electronic Building Blocks,” CrystEngComm (2019). DOI: 10.1039/C9CE00219G (CHE-1460568)
Y. Zou, X. Wang, J. Sims, B. Wang, P. Pandey. C. L. Welsh, R. P. Stone, M. A. Avery, R. J. Doerksen, D. Ferreira, C. Anklin, F. A. Valeriote, M. Kelly, and M. T. Hamann, “Computationally Assisted Discovery and Assignment of a Highly Strained and PANC-1 Selective Alkaloid from Alaska’s Deep Ocean,” Journal of the American Chemical Society, 141, 4338–4344 (2019). DOI: 410.1021/jacs.8b11403 (CHE-1460568)
N. I. Hammer and G. S. Tschumper, “Importance of a Truly Cohesive Theme in a REU Program,” in Best Practices for Chemistry REU Programs, edited by Mark Griep and Linette Watkins, ACS Books, 2018. DOI: 10.1021/bk-2018-1295.ch011
B. R. Westbrook, K. M. Dreux, G. S. Tschumper, J. S. Francisco, and R. C. Fortenberry, “Binding of the atomic cations hydrogen through argon to water and hydrogen sulfide,” Physical Chemistry Chemical Physics, 20, 25967-25973 (2018). DOI: 10.1039/C8CP05378B
S. G. Zetterholm, G. A. Verville, L. Boutwell, C. Boland, J. C. Prather, J. Bethea, J. Cauley, K. Warren, S. A. Smith, D. H. Magers, N. I. Hammer, “Noncovalent Interactions between Tri-methylamine N-oxide (TMAO), Urea, and Water,” Journal of Physical Chemistry B, 122, 8805–8811 (2018). DOI: 10.1021/acs.jpcb.8b04388
S. N. Johnson, C. R. Hutchison‡, C. M. Williams, C. L. Hussey, G. S. Tschumper, and N. I. Hammer, “Intermolecular Interactions and Vibrational Perturbations within Mixtures of 1-Ethyl-3-methylimidazolium Thiocyanate and Water,” Journal of Physical Chemistry C, 122, 27673-27680 (2018). DOI: 10.1021/acs.jpcc.8b07114
Y. Zhang, H. Cheema, A. E. London, A. Morales, J. D. Azoulay and J. H. Delcamp, “Panchromatic cross-conjugated π-bridge NIR dyes for DSCs,” Physical Chemistry Chemical Physics, 20, 2438-2443 (2018). DOI: 10.1039/C7CP06703H
Y. A. Abdo, J. W. Weeks, W. Layfield, W. M. Tremlett, J. W. Graham, M. E. Tabor, S. E. Causey, J. M. Carr, and G. S. Tschumper, “Intramolecular Hydrogen Bonding in α-Epoxy Alcohols: A Conformational Analysis of 1,2-Dialkyl-2,3-epoxycyclopentanol Diastereomers,” Chemistry Letters, 47, 156-159 (2018). DOI: 10.1246/cl.170932
J. D. Veals, K. N. Poland, W. P. Earwood, S. M. Yeager, K. L. Copeland, and S. R. Davis, “MRMP2, CCSD(T), and DFT Calculations of the Isomerization Barriers for the Disrotatory and Conrotatory Isomerizations of 3-Aza-3-ium-dihydrobenzvalene, 3,4-Diaza-3-ium-dihydrobenzvalene, and 3,4-Diaza-diium-dihydrobenzvalene,” Journal of Physical Chemistry A, 121, 8899–8911 (2017). DOI: 10.1021/acs.jpca.7b08227 (CHE-1460568)
N. P. Liyanage, H. Cheema, A. Baumann, A. R. Zylstra, and J. H. Delcamp, “Effect of Donor Strength and Bulk on Thieno[3,4-b]pyrazine based Panchromatic Dyes in DSCs,” ChemSusChem, 10, 2635–2641 (2017). DOI: 10.1002/cssc.201700546
M. Rambukwella, S. Burrage, M. Neubrander, Oscar Baseggio, E. Apra,̀ M. Stener, A. Fortunelli, and A. Dass, “Au38(SPh)24: Au38 Protected with Aromatic Thiolate Ligands,” The Journal of Physical Chemistry Letters, 8, 1530-1537 (2017). DOI: 10.1021/acs.jpclett.7b00193
A. J. Huckaba, A. Yella, L. E. McNamara, A. E. Steen, J. S. Murphy, C. A. Carpenter, G. D. Puneky, N. I. Hammer, M. K. Nazeeruddin, M. Grätzel, and J. H. Delcamp, “Molecular Design Principles of Near-Infrared Absorbing and Emitting Indolizine Dyes,” Chemistry - A European Journal, 22, 15536-15542 (2016). DOI: 10.1002/chem.201603165
J. T. Kelly, A. K. McClellan, L. V. Joe, A. M. Wright, L. T. Lloyd, G. S.
Tschumper, and N. I. Hammer, “Competition between Hydrophilic and Argyrophilic Interactions in Surface Enhanced Raman Spectroscopy (SERS),” ChemPhysChem, 17, 2782-2786 (2016). DOI: 10.1002/cphc.201600678
J. C. Howard, J. L. Gray, A. J. Hardwick, L. T. Nguyen and G. S. Tschumper, “Getting down to the Fundamentals of Hydrogen Bonding: Anharmonic Vibrational Frequencies of (HF)2 and (H2O)2 from Ab Initio Electronic Structure Computations),” Journal of Chemical Theory and Computation, 10, 5426-5435 (2014). DOI: 10.1021/ct500860v
D. N. Reinemann, G. S. Tschumper, and N. I. Hammer, “Characterizing
the B-P Stretching Vibration in Phosphorous Substituted Phosphine Boranes,”
ChemPhysChem, 15, 1867-1871 (2014). DOI: 10.1002/cphc.201400036
J. Coleman Howard and Gregory S. Tschumper, “Wavefunction methods for the accurate characterization of water clusters,” WIREs Computational Molecular Science, 4, 199–224 (2014). DOI: 10.1002/wcms.1168
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Originally created by undergraduate students Sarah Sutton and Genevieve Verville