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Jul 2020
  • Pai Li (李湃)
  • Periodic Table
  • Unit Conversion
  • Vasp
  • Scripts for job management system on super-computer
  • kMC simulation
  • Machine Learning tools
  • Python Scripts
    • Scripts
      • Adjust graphene island position on Cu surface
      • Calculate ionic conductivity in solid
      • Get MSD (mean square displacement) from MD trajectory (Python)
      • Get MSD (mean square displacement) from MD trajectory
      • Plot Phasediagram
      • Plot plain figures
  • VASP-VTST计算过渡态(NEB方法)具体过程
  • Math notation in Latex
  • Vim skills
  • A ReStructuredText Primer
  • PDF documents
  • Gallery of python scripts
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Python Scripts¶

This page contains python scripts

Scripts¶

  • Adjust graphene island position on Cu surface
  • Calculate ionic conductivity in solid
  • Get MSD (mean square displacement) from MD trajectory (Python)
  • Get MSD (mean square displacement) from MD trajectory
  • Plot Phasediagram
  • Plot plain figures
    • plot.py for plot data and save fig
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