PKMLab's repositories
MOIRE-LATTICE_NANO-TUBE
Python scripts for generating moiré lattices in twisted bilayer 2D materials and creating TMDC nanotubes.
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PKMLab.github.io
Lab website
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pvdf-cnt.ff
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.
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