quack/input/molecule

mirror of https://github.com/pfloos/quack synced 2024-11-07 06:33:55 +01:00
# nAt nEl nEla nElb
  1   2   1     1
# Znuc   x            y           z
  He      0.0          0.0         0.0
Fixing IntPak 2019-03-13 11:34:51 +01:00			`# nAt nEl nEla nElb`
			`1 2 1 1`
inital commit for quack 2019-02-07 22:49:12 +01:00			`# Znuc x y z`
Fixing IntPak 2019-03-13 11:34:51 +01:00			`He 0.0 0.0 0.0`