Skip to content

Latest commit

 

History

History
18 lines (15 loc) · 530 Bytes

README.md

File metadata and controls

18 lines (15 loc) · 530 Bytes

daily-use-scripts

1. poscar.py

Usage: poscar.py [OPTIONS]

  Parameters: number: Control whether number each line or not. atom: Control
  whether print the atom species or not. pos_type: Choose which coordinates
  to print.

Options:
  -f, --file TEXT  POSCAR File
  -n, --number     Show the number of atom
  -a, --atom       Show the species of atom
  -d, --direct     Choose Direct coordinates to print.
  -c, --cartesian  Choose Cartesian coordinates to print.
  --help           Show this message and exit.