Warning: This is an example potential. Please do NOT use it for any real simulations!

This is a Tersoff potential that can be used in potfit.

Example_Tersoff_1

#F 0 1
#T TERSOFF
#I 0
#E
 
type tersoff_pot
cutoff 6.0
A       1.00    -10.00  10.00
B       1.00    -10.00  10.00
lambda  1.00    -10.00  10.00
mu      1.00    -10.00  10.00
gamma   1.00    -10.00  10.00
n       1.00    -10.00  10.00
c       1.00    -10.00  10.00
d       1.00    -10.00  10.00
h       1.00    -10.00  10.00
S       1.00    -10.00  10.00
R       1.00    -10.00  10.00

Please note that there is only a tersoff_pot and no tersoff_mix potential for a single atom type.

The example potential can be generated with the following makeapot command:

makeapot -n 1 -i tersoff