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    4 repositories

    • MOIRE-LATTICE_NANO-TUBE

      Public
      Python scripts for generating moiré lattices in twisted bilayer 2D materials and creating TMDC nanotubes.
      Python
      •
      GNU General Public License v3.0
      •1•0•0•0•Updated Oct 13, 2024Oct 13, 2024

    • tekmc

      Public
      Trajectory-Extending Kinetic Monte Carlo
      Python
      •
      GNU General Public License v3.0
      •0•2•0•0•Updated Mar 6, 2024Mar 6, 2024

    • pvdf-cnt.ff

      Public
      GROMACS implementation of PVDF/CNT FF. PVDF from Sahihi et al. , J. Phys. Chem. C 2021 125 (39), 21635-21644, DOI: 10.1021/acs.jpcc.1c05894. CNT from OPLS-AA.
      simulationmolecular-dynamicsgromacsforcefieldcntpvdf
      Shell
      •0•1•0•0•Updated Apr 28, 2022Apr 28, 2022

    • PKMLab.github.io

      Public
      Lab website
      HTML
      •0•0•0•0•Updated Apr 4, 2022Apr 4, 2022