The Department of Chemistry at the University of North Carolina at Chapel Hill, offers a wide range of research opportunities in theoretical and experimental physical chemistry. Our program has broadened from its traditional areas of excellence in molecular chemical physics to include research activities in biophysical and materials sciences. Experimental efforts within these areas involve development and applications of state-of-the-art instrumentations, such as high-resolution ultra-fast laser systems, molecular beam techniques, multi-dimensional spectroscopies, and near-field optics, et cetera.
In addition to traditional areas of chemical theory, recent theoretical chemistry research involves development and applications of new computational methods in quantum/statistical mechanics and polymer physics for studying novel physical phenomena in a wide range of systems from nano-materials to biological membranes. Students have access to several massively parallel high-performance computers at UNC Research Computing, one of the best university computing facilities in the country.
The University of North Carolina at Chapel Hill is also home to home to a number of theoretical/computational research groups that are interested in studying exciting problems in molecular, materials, and condensed matter sciences.
Recent Research Results
Journal of Chemical Physics.
Multidimensional time-of-flight spectroscopy Zhenyu Ouyang, Ninghao Zhou, Meredith G. McNamee, Liang Yan, Olivia F. Williams, Wei You and Andrew M. Moran Journal of Chemical Physics 2021 154 (22), 220901 DOI: 10.1063/5.0047382
Electrochemical quantification of accelerated FADGDH rates in aqueous nanodroplets Kathryn J. Vannoy, Inyoung Lee, Koji Sode and Jeffrey E. Dick PNAS June 22, 2021 118 (25), e2025726118 DOI: 10.1073/pnas.2025726118
The Journal of Physical Chemistry.
Stretch-Induced Cavitation: How Critical Cavity Radius and Barrier Energy, Radius, and Energy of a Stable Cavity Depend on the Stretching Factor Max L. Berkowitz The Journal of Physical Chemistry B 2021 125 (17), 4409-4414 DOI: 10.1021/acs.jpcb.1c00096
Coating small-diameter ePTFE vascular grafts with tunable poly(diol-co-citrate-co-ascorbate) elastomers to reduce neointimal hyperplasia Lu Yu, Emily R. Newton, David C. Gillis, Kui Sun, Brian C. Cooley, Andrew N. Keith, Sergei S. Sheiko, Nick D. Tsihlis, and Melina R. Kibbe Biomaterials Science 2021, Advance Article DOI: 10.1039/D1BM00101A
The Journal of Chemical Physics.
Dynamical transition orbitals: A particle–hole description in real-time TDDFT dynamics Ruiyi Zhou and Yosuke Kanaia The Journal of Chemical Physics 2021 154(5) DOI: 10.1063/5.0035435
The Journal of Physical Chemistry Letters.
Elucidation of Quantum-Well-Specific Carrier Mobilities in Layered Perovskites Ninghao Zhou, Zhenyu Ouyang, Liang Yan, Meredith G. McNamee, Wei You, and Andrew M. Moran The Journal of Physical Chemistry Letters 2021 12 (4), 1116-1123 DOI: 10.1021/acs.jpclett.0c03596
Applied Physics Letters.
Microscopic origin of inhomogeneous transport in four-terminal tellurene devices Benjamin M. Kupp, Gang Qiu, Yixiu Wang, Clayton B. Casper, Thomas M. Wallis, Joanna M. Atkin, Wenzhuo Wu, Peide D. Ye, Pavel Kabos, and Samuel Berweger Applied Physics Letters 2020 117 (25), 253102 DOI: 10.1063/5.0025955
Electrolyte-Free Spectroscopy and Imaging of Graphite Intercalation Madeline S. Stark Judy Cheng Hailey Kim Kaci L. Kuntz Scott C. Warren Small 2020, 2004823. DOI: 10.1002/smll.202004823