CAVS Publications
Search Publications
Dickel, D. E., Mun, S., Baskes, M. I., Gwaltney, S. R., Prabhu, R., & Horstemeyer, M. (2022). Density Functional Theory and Bridging to Classical Interatomic Force Fields. In R. K. Prabhu and M. F. Horstemeyer (Eds.), in Multiscale Biomechanical Modeling of the Brain. Academic Press. 39-52. DOI:10.1016/B978-0-12-818144-7.00007-4.
Peer-Reviewed Journals
Ababtin, S. A., Adibi, S., Mun, S., Dickel, D. E., Gwaltney, S. R., Novotny, M.A., Baskes, M. I., & Horstemeyer, M. (2022). Single-Wall Carbon Nanotube Mechanical Behavior Using the Modified Embedded Atom Method with Bond Order (MEAMBO). Modelling Simul. Mater. Sci. Eng.. 30, 035004. DOI:10.1088/1361-651X/ac4d75.
Bowman, A., Mun, S., Huddleston, B. D., Gwaltney, S. R., Baskes, M. I., & Horstemeyer, M. (2021). A Nanoscale Study of Size Scale, Strain Rate, Temperature, and Stress State Effects on Damage and Fracture of Polyethylene. Mech. Mater.. 161, 104008. DOI:10.1016/j.mechmat.2021.104008.
Bakhtiarydavijani, A., Murphy, M. A., Mun, S., Jones, M. D., Bammann, D., LaPlaca, M. C., Horstemeyer, M., & Prabhu, R. (2019). Damage Biomechanics for Neuronal Membrane Mechanoporation. Modelling and Simulation in Materials Science and Engineering. 27, 065004. DOI:10.1088/1361-651X/ab1efe. [Abstract]
Bowman, A., Mun, S., Nouranian, S., Huddleston, B. D., Gwaltney, S. R., Baskes, M. I., & Horstemeyer, M. (2019). Free Volume and Internal Structural Evolution during Creep in Model Amorphous Polyethylene by Molecular Dynamics Simulations. Polymer. Elsevier. 170, 85-100. DOI:10.1016/j.polymer.2019.02.060. [Abstract] [Document Site]
Dickel, D. E., Gwaltney, S. R., Mun, S., Baskes, M. I., & Horstemeyer, M. (2018). Dispersion-Corrected Modified Embedded-Atom Method Bond Order Interatomic Potential for Sulfur. Journal of Physical Chemistry A. 122(49), 9572–9578. DOI:10.1021/acs.jpca.8b07410.
Murphy, M. A., Mun, S., Horstemeyer, M., Baskes, M. I., Bakhtiary, A., LaPlaca, M. C., Gwaltney, S. R., Williams, L. N., & Prabhu, R. (2018). Molecular Dynamics Simulations Showing 1-Palmitoyl-2-Oleoyl-Phosphatidylcholine (POPC) Membrane Mechanoporation Damage under Different Strain Paths. Journal of Biomolecular Structure & Dynamics. 1-14. DOI:10.1080/07391102.2018.1453376. [Abstract] [Document]
Lee, N, Williams, L. N., Mun, S., Rhee, H., Prabhu, R., Bhattarai, K. R., & Horstemeyer, M. (2017). Stress Wave Mitigation at Suture Interfaces. Biomedical Physics & Engineering Express. IOP Publishing Ltd. 3, 035025. DOI:10.1088/2057-1976/aa777e. [Abstract] [Document] [Document Site]
Mun, S., Bowman, A., Nouranian, S., Gwaltney, S. R., Baskes, M. I., & Horstemeyer, M. (2017). Interatomic Potential for Hydrocarbons on the Basis of the Modified Embedded-Atom Method with Bond Order (MEAM-BO). The Journal of Physical Chemistry A. ACS Publications. 121(7), 1502–1524. DOI:10.1021/acs.jpca.6b11343. [Document]
Mun, S., Sassenrath, G. F., Lee, N, Schmidt, A. M., Wadsworth, M. C., Rice, B., Corbitt, J. Q., Schneider, J. M., Tagert, M. L., Pote, J. W., & Prabhu, R. (2015). Uncertainty Analysis of An Irrigation Scheduling Model for Water Management in Crop Production. Agricultural Water Management. Elsevier. 155, 100–112. DOI:10.1016/j.agwat.2015.03.009. [Document Site]
Professional Presentations
Bowman, A., Mun, S., Horstemeyer, M., & Baskes, M. I. (2019). Multi-threading Extension of MEAM Force Field in Molecular Dynamic Simulations. High-Performance Computing Modernization Program (HPCMP) User Group Meeting (UGM). Vicksburg, MS: U.S. Army Engineer Research and Development Center (ERDC). [Abstract]
Ababtin, S. A., Mun, S., Carino, R.L., Bowman, A., Baskes, M. I., & Horstemeyer, M. (2019). Multiscale Interfacial Characteristics of Single Wall Carbon Nanotube (SWCNT) Composites Embedded Within Polyethylene (PE). TMS 2019 Annual Meeting & Exhibition. San Antonio, TX.
Murphy, M. A., Mun, S., Baskes, M. I., Horstemeyer, M., & Prabhu, R. (2018). Quantifying Strain State Effect on Neuronal Membrane Damage. 18th U.S. National Congress for Theoretical and Applied Mechanics. Rosemont, IL. [Abstract]
Bakhtiary, A., Prabhu, R., Horstemeyer, M., Murphy, M. A., Mun, S., LaPlaca, M. C., & Jones, M. D. (2017). Mechano-physiological Damage Modeling of Neuronal Death Due to Traumatic Brain Injury. International Mechanical Engineering Congress & Exposition. Tampa, FL: American Society of Mechanical Engineers. [Abstract]