# rx parameters for various molecules
# multiple entries can be added to this file, LAMMPS reads the ones it needs
# these entries are in LAMMPS "metal" units:
#   alpha = unitless; epsilon = eV; rho = Angstroms; 

# format of a single entry (one or more lines):
#   species, exp6, alpha, epsilon, rm

hcn     exp6  13.57  0.030862657941745  5.3725
no2     exp6  13.57  0.029126283357001  4.2744
no      exp6  13.10  0.013090454747817  3.7142
h2o     exp6  11.01  0.022473771300313  3.5348
co      exp6  13.24  0.0086353397713660428  4.1759
co2     exp6  14.09  0.019672305322873507  4.1757
h2      exp6  11.23  0.002618780329051 3.4925
n2      exp6  12.97  0.008635339808299 4.1778