Molecular Dynamics in Carbon and Carbon-Rich Materials

Presentations

• Phase transitions of carbon at extreme conditions

  ORAL · Invited

  July 14, 2022, 2:00 PM – July 14, 2022, 2:30 PM

  Presenters

  • Kien Nguyen-Cong

    • University of South Florida

  Authors

  • Kien Nguyen-Cong

    • University of South Florida

  • Jonathan T Willman

    • University of South Florida
    • Univ of South Florida

  • Anatoly B Belonoshko

    • Royal Institute of Technology

  • Ivan Oleynik

    • University of South Florida

  View abstract →

• A model for ramp compression from ab initio calculations

  ORAL

  July 14, 2022, 2:30 PM – July 14, 2022, 2:45 PM

  Publication: González-Cataldo, F., Godwal, B. K., Driver, K., Jeanloz, R., & Militzer, B. (2021). Model of ramp compression of diamond from ab initio simulations. Physical Review B, 104(13), 134104. https://doi.org/10.1103/PhysRevB.104.134104

  Presenters

  • Felipe J Gonzalez

    • University of California, Berkeley

  Authors

  • Felipe J Gonzalez

    • University of California, Berkeley

  • Burkhard Militzer

    • University of California, Berkeley

  • Raymond Jeanloz

    • University of California, Berkeley

  • Budhiram K Godwal

    • University of California, Berkeley

  • Kevin P Driver

    • Lawrence Livermore Natl Lab

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• Progress and Future Directions: The ChIMES Machine Learned Interatomic Model Framework for Chemistry in Energetic Materials

  ORAL

  July 14, 2022, 2:45 PM – July 14, 2022, 3:00 PM

  Presenters

  • Rebecca K Lindsey

    • Lawrence Livermore Natl Lab
    • Lawrence Livermore National Lab

  Authors

  • Rebecca K Lindsey

    • Lawrence Livermore Natl Lab
    • Lawrence Livermore National Lab

  • Cong Huy Pham

    • Lawrence Livermore Natl Lab

  • Nir Goldman

    • Lawrence Livermore Natl Lab

  • Laurence E Fried

    • Lawrence Livermore Natl Lab
    • LLNL

  • Sorin Bastea

    • Lawrence Livermore Natl Lab
    • Lawrence Livermore National Laboratory

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• Inelastic Deformations in Shock Compressed Diamond

  ORAL

  July 14, 2022, 3:00 PM – July 14, 2022, 3:15 PM

  Presenters

  • Jonathan T Willman

    • University of South Florida
    • Univ of South Florida

  Authors

  • Jonathan T Willman

    • University of South Florida
    • Univ of South Florida

  • Kien Nguyen-Cong

    • University of South Florida

  • Ivan Oleynik

    • University of South Florida

  View abstract →