trivial.py
No OneTemporary
Actions

Subscribers

None

File Metadata

	#!/usr/bin/env python -i
	# preceding line should have path for Python on your machine

	# trivial.py
	# Purpose: run a LAMMPS input script via Python
	# Syntax: trivial.py in.lammps
	# in.lammps = LAMMPS input script

	from __future__ import print_function
	import sys

	# parse command line

	argv = sys.argv
	if len(argv) != 2:
	print("Syntax: trivial.py in.lammps")
	sys.exit()

	infile = sys.argv[1]

	from lammps import lammps
	lmp = lammps()

	# run infile all at once

	lmp.file(infile)

	# or run infile one line at a time

	#lines = open(infile,'r').readlines()
	#for line in lines: lmp.command(line)