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  4. May 2014

News

Christine and Enrique attend the ACS Undergraduate Symposium at the University of San Francisco (Christine's alma mater)

May 03, 2014

Latest News

  • Adding memory to electron propagation - published in Journal of Mathematical Physics

    January 15, 2025

    rdm

    In this paper, we shed light on the memory-dependence of 1-electron reduced density matrices derived from time-dependent configuration interaction (TDCI). Though time-dependent density functional...

    Read More Adding memory to electron propagation - published in Journal of Mathematical Physics
  • Paper with Harish and Prachi is published in APL Machine Learning and chosen for the cover.

    December 01, 2024

    cover

  • Collaboration with Nandini Ananth on GPU-Accelerated NAMD published in JCP

    August 28, 2024

    This JCP article showcases our work collaborating with Nandini Ananth's group to  accelerate the LSC-IVR nonadiabatic dynamics method by developing an interface with TeraChem. Code available on GitHub...

    Read More Collaboration with Nandini Ananth on GPU-Accelerated NAMD published in JCP
  • Time for Ajay to defend his Ph.D.! Then he heads off to a postdoc at LANL with Sergei Tretiak.

    July 31, 2024

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