Ba
1.34338e+01
-1.41600e-01
6.56980e-01
5.37300e+00

# Row 1: `rcut' cutoff value in Angstroms
# Row 2: Morse `epsilon' value in eV
# Row 3: Morse `C' value in 1/Angstroms
# Row 4: Morse `Rzero' value in Angstroms
# (See README for Pair_Morse_Shifted__MD_552566534109_001 for further details.)
#
# Parameters (epsilon, C, Rzero) for Ba taken from:
#    L. A. Girifalco, V. G. Weizer, Phys. Rev., Vol 114, no 3, 1959, pp687--690
#
# The cutoff radius is computed so that
#
# phi(rcut)=tol*|phi(rmin)|,   (*)
#
# where phi(r) is the Morse potential, 'rcut' is the cutoff radius,
# `rmin' is the radius at which phi(r) is a minimum, and
# `tol' is a small number.  Here, (*) is solved numerically for `rcut'.
#
# `cutoff' in this file is for a "Low" tolerance of tol = 1.00000e-02.
#

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# Copyright (c) 2013, Regents of the University of Minnesota.
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# Contributors:
#    Ryan S. Elliott
#