Publications

  1. Holden T. Smith, Tony E. Karam, Louis H. Haber, and Kenneth Lopata (2017). Capturing Plasmon–Molecule Dynamics in Dye Monolayers on Metal Nanoparticles Using Classical Electrodynamics with Quantum Embedding. The Journal of Physical Chemistry C. DOI: 10.1021/acs.jpcc.7b03440
  2. Abanador, P. M., Mauger, F., Lopata, K., Gaarde, M. B., & Schafer, K. J. (2017). Semiclassical modeling of high-order harmonic generation driven by an elliptically polarized laser field: the role of recolliding periodic orbits. Journal of Physics B: Atomic, Molecular and Optical Physics, 50(3), 035601.
  3. Mauger, F., Abanador, P. M., Lopata, K., Schafer, K. J., & Gaarde, M. B. (2016). Semiclassical-wave-function perspective on high-harmonic generation. Physical Review A, 93(4), 043815.
  4. Sissay, Adonay, Paul Abanador, François Mauger, Mette Gaarde, Kenneth J. Schafer, and Kenneth Lopata. “Angle-dependent strong-field molecular ionization rates with tuned range-separated time-dependent density functional theory.” The Journal of chemical physics 145, no. 9 (2016): 094105.
  5. Bruner, A., LaMaster, D., & Lopata, K. (2016). Accelerated broadband spectra using transition dipole decomposition and Padé approximants. Journal of Chemical Theory and Computation, 12(8), 3741-3750.
  6. S. Tussupbayev, N. Govind, K. Lopata, and C. J. Cramer, “Comparison of real-time and linear-response time-dependent density functional theories for molecular chromophores ranging from sparse to high densities of states,” J. Chem. Theory Comput. 11, 1102 – 1109 (2015).
  7. R. Fernando, M. C. Balhoff, and K. Lopata, “X-ray absorption in insulators with non-Hermitian real-time time-dependent density functional theory,” J. Chem. Theory Comput. 11, 646 – 654 (ACS Editors’ Choice)

Funding

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