Faculty Accomplishments

Jiang, Y., Minett, M., Hazen, E., Wang, W., Alvarez, C., Griffin, J., Nancy, J., & Chen, W. (2022) New Insights into Spin Coating of Polymer Thin Films in Both Wetting and Nonwetting Regimes. Langmuir, 38(41), 12702–12710. DOI: 10.1021/acs.langmuir.2c02206

Maria Alexandra Gomez was a Co-PI on National Science Foundation (NSF) project: MRI: Expansion of the Molecular Education and Research Consortium in Undergraduate Computational Chemistry (MERCURY) via Addition of High Performance Computers awarded to Furman University. The project is for three years. 

Gomez, M. A., Brooks-Randall, S., Cai, G., Glass-Klaiber, J., Jiang, Y., Jo, S., Lin, Z., Lin, S., Marcellus, M., Nguyen, H. A., Pham, T., Wang, Y., Zhai, F., Gya, P., Khan, S. (2021). Graph analysis of proton conduction pathways in scandium-doped barium zirconate. The Journal of Chemical Physics, 154(7), 074711. doi:10.1063/5.0039103

Patel, M., Zhong, J., Gomez-Haibach, K. S., Gomez, M. A., & King, G. (2020). Low-energy Sr2MSbO5.5(M = Ca and Sr) structures show significant distortions near oxygen vacancies. International Journal of Quantum Chemistry. doi:10.1002/qua.26356

Torayev, A., Sperrin, L., Gomez, M. A., Kattirtzi, J. A., Merlet, C., & Grey, C. P. (2020). Local Distortions and Dynamics in Hydrated Y-Doped BaZrO3. J Phys Chem C Nanomater Interfaces, 124(30), 16689-16701. doi:10.1021/acs.jpcc.0c04594

Du, P., Chen, Q., Fan, Z., Pan, H., Haibach, F. G., Gomez, M. A., & Braun, A. (2020). Cooperative origin of proton pair diffusivity in yttrium substituted barium zirconate. Communications Physics, 3(1). doi:10.1038/s42005-020-00464-5

Lin, Z., Lin, S., Tian, Y., Van Bokkelen, A., Valerio, M., & Gomez, M. A. (2020). Oxygen Vacancies Altering the Trapping in the Proton Conduction Landscape of Doped Barium Zirconate. The Journal of Physical Chemistry C, 124(51), 27954-27964. doi:10.1021/acs.jpcc.0c09461

Lynch, D. E., Reeves, C. R., Errabelli, D. R., & Hamilton, D. G. (2021). Structure of a potassium salt of Lasalocid A and an investigation of solid–state conformational variance of the Lasalocid A backbone in known complexes. Journal of Molecular Structure, 1229. doi: 10.1016/j.molstruc.2020129768

Wang C., Teng L., Liu Z.S., Kamalova A., McMenimen KA., HspB5 Chaperone Structure and Activity Are Modulated by Chemical-Scale Interactions in the ACD Dimer Interface. International Journal of Molecular Sciences. 2024; 25(1):471. https://doi.org/10.3390/ijms25010471

Rittika Shamsuddin*, Milka Doktorova*, Sheila Jaswal, Audrey Lee-St. John and Kathryn McMenimen. Computational Prediction of Hinge Axes in Proteins. BMC Bioinformatics, 15(8), 2014
* indicates undergraduate author