# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2003--Nord-J-Albe-K-Erhart-P-Nordlund-K--Ga-N # implementation = Tersoff_LAMMPS_NordAlbeErhart_2003_GaN__MO_612061685362_003 # composition = GaN2 # NOTE: These values are for static, unrelaxed structures and use the ideal # b/a and c/a ratios for the crystal structure, not the potential-specific # values. # Calculations from the NIST Interatomic Potential Repository Project: # http://www.ctcms.nist.gov/potentials/ # Table generated 2022-10-04 r C1--CaF2--fluori 0.50 nan 0.52 nan 0.54 nan 0.56 nan 0.58 nan 0.60 nan 0.62 nan 0.64 nan 0.66 4.291001418e+03 0.68 3.845694604e+03 0.70 3.467415351e+03 0.72 3.142206981e+03 0.74 2.851952435e+03 0.76 2.596574152e+03 0.78 2.363671356e+03 0.80 2.152472622e+03 0.82 1.958255661e+03 0.84 1.779765167e+03 0.86 1.614398995e+03 0.88 1.465239113e+03 0.90 1.337649818e+03 0.92 1.229171291e+03 0.94 1.128438300e+03 0.96 1.032707596e+03 0.98 9.424210046e+02 1.00 8.592051254e+02 1.02 7.864812414e+02 1.04 7.259062578e+02 1.06 6.727145850e+02 1.08 6.243744909e+02 1.10 5.769759270e+02 1.12 5.304086678e+02 1.14 4.855647371e+02 1.16 4.434180977e+02 1.18 4.050371825e+02 1.20 3.712844137e+02 1.22 3.426154327e+02 1.24 3.186561999e+02 1.26 2.964638786e+02 1.28 2.754982423e+02 1.30 2.557796059e+02 1.32 2.372210746e+02 1.34 2.196035285e+02 1.36 2.028994594e+02 1.38 1.871377133e+02 1.40 1.724084511e+02 1.42 1.586989181e+02 1.44 1.452615678e+02 1.46 1.323894120e+02 1.48 1.202626485e+02 1.50 1.083038950e+02 1.52 9.660946975e+01 1.54 8.544641680e+01 1.56 7.517623665e+01 1.58 6.626960618e+01 1.60 5.922541460e+01 1.62 5.435727759e+01 1.64 5.061867609e+01 1.66 4.712736768e+01 1.68 4.382410092e+01 1.70 4.060408214e+01 1.72 3.751302511e+01 1.74 3.459825729e+01 1.76 3.181794085e+01 1.78 2.918532583e+01 1.80 2.670463506e+01 1.82 2.435357812e+01 1.84 2.209674469e+01 1.86 1.989764097e+01 1.88 1.772216835e+01 1.90 1.554945556e+01 1.92 1.335542560e+01 1.94 1.111107573e+01 1.96 8.784576368e+00 1.98 6.348762211e+00 2.00 3.801930877e+00 2.02 1.216263767e+00 2.04 -1.176827728e+00 2.06 -2.923397117e+00 2.08 -3.520425570e+00 2.10 -3.543946826e+00 2.12 -3.554598725e+00 2.14 -3.553707691e+00 2.16 -3.542494053e+00 2.18 -3.522079658e+00 2.20 -3.493494975e+00 2.22 -3.457685712e+00 2.24 -3.415518987e+00 2.26 -3.367789076e+00 2.28 -3.315222770e+00 2.30 -3.258484366e+00 2.32 -3.198180307e+00 2.34 -3.134863514e+00 2.36 -3.069037408e+00 2.38 -3.001159656e+00 2.40 -2.931645659e+00 2.42 -2.860871791e+00 2.44 -2.789178413e+00 2.46 -2.716872676e+00 2.48 -2.644231122e+00 2.50 -2.571502104e+00 2.52 -2.498908033e+00 2.54 -2.426647459e+00 2.56 -2.354897010e+00 2.58 -2.283813184e+00 2.60 -2.213534018e+00 2.62 -2.144180626e+00 2.64 -2.075858632e+00 2.66 -2.008659494e+00 2.68 -1.942661730e+00 2.70 -1.877932054e+00 2.72 -1.805791032e+00 2.74 -1.718640113e+00 2.76 -1.618243753e+00 2.78 -1.506492419e+00 2.80 -1.385416776e+00 2.82 -1.257195083e+00 2.84 -1.124149969e+00 2.86 -9.887317415e-01 2.88 -8.534864319e-01 2.90 -7.210078112e-01 2.92 -5.938738043e-01 2.94 -4.745690225e-01 2.96 -3.653966462e-01 2.98 -2.683845556e-01 3.00 -1.851922934e-01 3.02 -1.170268910e-01 3.04 -6.457638646e-02 3.06 -2.796958626e-02 3.08 -6.768914804e-03 3.10 0.000000000e+00 3.12 0.000000000e+00 3.14 0.000000000e+00 3.16 0.000000000e+00 3.18 0.000000000e+00 3.20 0.000000000e+00 3.22 0.000000000e+00 3.24 0.000000000e+00 3.26 0.000000000e+00 3.28 0.000000000e+00 3.30 0.000000000e+00 3.32 0.000000000e+00 3.34 0.000000000e+00 3.36 0.000000000e+00 3.38 0.000000000e+00 3.40 0.000000000e+00 3.42 0.000000000e+00 3.44 0.000000000e+00 3.46 0.000000000e+00 3.48 0.000000000e+00 3.50 0.000000000e+00 3.52 0.000000000e+00 3.54 0.000000000e+00 3.56 0.000000000e+00 3.58 0.000000000e+00 3.60 0.000000000e+00 3.62 0.000000000e+00 3.64 0.000000000e+00 3.66 0.000000000e+00 3.68 0.000000000e+00 3.70 0.000000000e+00 3.72 0.000000000e+00 3.74 0.000000000e+00 3.76 0.000000000e+00 3.78 0.000000000e+00 3.80 0.000000000e+00 3.82 0.000000000e+00 3.84 0.000000000e+00 3.86 0.000000000e+00 3.88 0.000000000e+00 3.90 0.000000000e+00 3.92 0.000000000e+00 3.94 0.000000000e+00 3.96 0.000000000e+00 3.98 0.000000000e+00 4.00 0.000000000e+00 4.02 0.000000000e+00 4.04 0.000000000e+00 4.06 0.000000000e+00 4.08 0.000000000e+00 4.10 0.000000000e+00 4.12 0.000000000e+00 4.14 0.000000000e+00 4.16 0.000000000e+00 4.18 0.000000000e+00 4.20 0.000000000e+00 4.22 0.000000000e+00 4.24 0.000000000e+00 4.26 0.000000000e+00 4.28 0.000000000e+00 4.30 0.000000000e+00 4.32 0.000000000e+00 4.34 0.000000000e+00 4.36 0.000000000e+00 4.38 0.000000000e+00 4.40 0.000000000e+00 4.42 0.000000000e+00 4.44 0.000000000e+00 4.46 0.000000000e+00 4.48 0.000000000e+00 4.50 0.000000000e+00 4.52 0.000000000e+00 4.54 0.000000000e+00 4.56 0.000000000e+00 4.58 0.000000000e+00 4.60 0.000000000e+00 4.62 0.000000000e+00 4.64 0.000000000e+00 4.66 0.000000000e+00 4.68 0.000000000e+00 4.70 0.000000000e+00 4.72 0.000000000e+00 4.74 0.000000000e+00 4.76 0.000000000e+00 4.78 0.000000000e+00 4.80 0.000000000e+00 4.82 0.000000000e+00 4.84 0.000000000e+00 4.86 0.000000000e+00 4.88 0.000000000e+00 4.90 0.000000000e+00 4.92 0.000000000e+00 4.94 0.000000000e+00 4.96 0.000000000e+00 4.98 0.000000000e+00 5.00 0.000000000e+00 5.02 0.000000000e+00 5.04 0.000000000e+00 5.06 0.000000000e+00 5.08 0.000000000e+00 5.10 0.000000000e+00 5.12 0.000000000e+00 5.14 0.000000000e+00 5.16 0.000000000e+00 5.18 0.000000000e+00 5.20 0.000000000e+00 5.22 0.000000000e+00 5.24 0.000000000e+00 5.26 0.000000000e+00 5.28 0.000000000e+00 5.30 0.000000000e+00 5.32 0.000000000e+00 5.34 0.000000000e+00 5.36 0.000000000e+00 5.38 0.000000000e+00 5.40 0.000000000e+00 5.42 0.000000000e+00 5.44 0.000000000e+00 5.46 0.000000000e+00 5.48 0.000000000e+00 5.50 0.000000000e+00 5.52 0.000000000e+00 5.54 0.000000000e+00 5.56 0.000000000e+00 5.58 0.000000000e+00 5.60 0.000000000e+00 5.62 0.000000000e+00 5.64 0.000000000e+00 5.66 0.000000000e+00 5.68 0.000000000e+00 5.70 0.000000000e+00 5.72 0.000000000e+00 5.74 0.000000000e+00 5.76 0.000000000e+00 5.78 0.000000000e+00 5.80 0.000000000e+00 5.82 0.000000000e+00 5.84 0.000000000e+00 5.86 0.000000000e+00 5.88 0.000000000e+00 5.90 0.000000000e+00 5.92 0.000000000e+00 5.94 0.000000000e+00 5.96 0.000000000e+00 5.98 0.000000000e+00 6.00 0.000000000e+00