# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2011--Zhou-X-W-Doty-F-P-Yang-P--Li-Na-K-Rb-Cs-F-Cl-Br-I
# implementation = 2011--Zhou-X-W--Li-Na-K-Rb-Cs-F-Cl-Br-I--LAMMPS--ipr1
# composition = CsF2
# 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 2022-05-24

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  nan             
0.68  nan             
0.70  nan             
0.72  nan             
0.74  nan             
0.76  nan             
0.78  nan             
0.80  nan             
0.82  nan             
0.84  nan             
0.86  nan             
0.88  nan             
0.90  nan             
0.92  nan             
0.94  nan             
0.96  nan             
0.98  nan             
1.00  nan             
1.02  nan             
1.04  nan             
1.06  nan             
1.08  nan             
1.10  3.696921945e+06 
1.12  nan             
1.14  2.251902111e+06 
1.16  1.768838010e+06 
1.18  1.395067331e+06 
1.20  1.104610309e+06 
1.22  8.779528905e+05 
1.24  7.003668595e+05 
1.26  5.606845783e+05 
1.28  4.504005603e+05 
1.30  3.630090708e+05 
1.32  2.935130054e+05 
1.34  2.380583748e+05 
1.36  1.936610359e+05 
1.38  1.580021016e+05 
1.40  1.292719519e+05 
1.42  1.060542961e+05 
1.44  8.723640316e+04 
1.46  7.194088830e+04 
1.48  5.947409209e+04 
1.50  4.928564304e+04 
1.52  4.093736892e+04 
1.54  3.407958906e+04 
1.56  2.843243763e+04 
1.58  2.377101880e+04 
1.60  1.991431310e+04 
1.62  1.671620843e+04 
1.64  1.405848204e+04 
1.66  1.184508815e+04 
1.68  9.997918318e+03 
1.70  8.453281283e+03 
1.72  7.159111978e+03 
1.74  6.072757907e+03 
1.76  5.159153599e+03 
1.78  4.389464934e+03 
1.80  3.739891516e+03 
1.82  3.190766497e+03 
1.84  2.725814961e+03 
1.86  2.331513750e+03 
1.88  1.996595103e+03 
1.90  1.711694822e+03 
1.92  1.468995285e+03 
1.94  1.261957422e+03 
1.96  1.085103572e+03 
1.98  9.338437589e+02 
2.00  8.043110413e+02 
2.02  6.932446030e+02 
2.04  5.979013194e+02 
2.06  5.159639902e+02 
2.08  4.454719064e+02 
2.10  3.847653266e+02 
2.12  3.324342722e+02 
2.14  2.872797415e+02 
2.16  2.482869071e+02 
2.18  2.145856091e+02 
2.20  1.854341833e+02 
2.22  1.601999050e+02 
2.24  1.383417547e+02 
2.26  1.193963701e+02 
2.28  1.029664106e+02 
2.30  8.871079832e+01 
2.32  7.633641838e+01 
2.34  6.559053691e+01 
2.36  5.625646533e+01 
2.38  4.814749532e+01 
2.40  4.110400639e+01 
2.42  3.498333248e+01 
2.44  2.966484239e+01 
2.46  2.504412289e+01 
2.48  2.103071588e+01 
2.50  1.754620065e+01 
2.52  1.452248989e+01 
2.54  1.190038499e+01 
2.56  9.628529478e+00 
2.58  7.662291052e+00 
2.60  5.962753355e+00 
2.62  4.495806361e+00 
2.64  3.232160239e+00 
2.66  2.146061320e+00 
2.68  1.215014336e+00 
2.70  4.194782761e-01 
2.72 -2.575166433e-01 
2.74 -8.315885847e-01 
2.76 -1.315524554e+00 
2.78 -1.720800046e+00 
2.80 -2.057460454e+00 
2.82 -2.334305651e+00 
2.84 -2.559049520e+00 
2.86 -2.738458571e+00 
2.88 -2.878472361e+00 
2.90 -2.984308087e+00 
2.92 -3.060551404e+00 
2.94 -3.111235244e+00 
2.96 -3.139908214e+00 
2.98 -3.149693922e+00 
3.00 -3.143342438e+00 
3.02 -3.123494051e+00 
3.04 -3.092061177e+00 
3.06 -3.050859193e+00 
3.08 -3.001548855e+00 
3.10 -2.945586140e+00 
3.12 -2.884245687e+00 
3.14 -2.818640897e+00 
3.16 -2.749741481e+00 
3.18 -2.678388999e+00 
3.20 -2.605310684e+00 
3.22 -2.531131805e+00 
3.24 -2.456392034e+00 
3.26 -2.381547683e+00 
3.28 -2.306976725e+00 
3.30 -2.232992709e+00 
3.32 -2.159854485e+00 
3.34 -2.087795698e+00 
3.36 -2.016972781e+00 
3.38 -1.947514416e+00 
3.40 -1.879521973e+00 
3.42 -1.813069664e+00 
3.44 -1.748208744e+00 
3.46 -1.684971271e+00 
3.48 -1.623373444e+00 
3.50 -1.563418540e+00 
3.52 -1.505099307e+00 
3.54 -1.448400400e+00 
3.56 -1.393300784e+00 
3.58 -1.339774344e+00 
3.60 -1.287791643e+00 
3.62 -1.237321011e+00 
3.64 -1.188329416e+00 
3.66 -1.140783154e+00 
3.68 -1.094652035e+00 
3.70 -1.050239714e+00 
3.72 -1.007099551e+00 
3.74 -9.652125568e-01 
3.76 -9.245576938e-01 
3.78 -8.851133482e-01 
3.80 -8.468575334e-01 
3.82 -8.097680585e-01 
3.84 -7.738593066e-01 
3.86 -7.390669057e-01 
3.88 -7.053653506e-01 
3.90 -6.727347821e-01 
3.92 -6.411552610e-01 
3.94 -6.106068827e-01 
3.96 -5.810698730e-01 
3.98 -5.525246675e-01 
4.00 -5.249519736e-01 
4.02 -4.983328182e-01 
4.04 -4.726485805e-01 
4.06 -4.478810114e-01 
4.08 -4.240122407e-01 
4.10 -4.010247725e-01 
4.12 -3.789014697e-01 
4.14 -3.576255301e-01 
4.16 -3.371804531e-01 
4.18 -3.175499999e-01 
4.20 -2.987181480e-01 
4.22 -2.806690406e-01 
4.24 -2.633869336e-01 
4.26 -2.468686918e-01 
4.28 -2.310857761e-01 
4.30 -2.160210460e-01 
4.32 -2.016585909e-01 
4.34 -1.879827834e-01 
4.36 -1.749776186e-01 
4.38 -1.626267977e-01 
4.40 -1.509137456e-01 
4.42 -1.398215872e-01 
4.44 -1.293331310e-01 
4.46 -1.194308613e-01 
4.48 -1.100969388e-01 
4.50 -1.013132092e-01 
4.52 -9.306122048e-02 
4.54 -8.532224822e-02 
4.56 -7.807732779e-02 
4.58 -7.130729389e-02 
4.60 -6.499282604e-02 
4.62 -5.911449922e-02 
4.64 -5.365283902e-02 
4.66 -4.858804885e-02 
4.68 -4.389838746e-02 
4.70 -3.956764514e-02 
4.72 -3.557671804e-02 
4.74 -3.190676078e-02 
4.76 -2.853924632e-02 
4.78 -2.545602357e-02 
4.80 -2.263937167e-02 
4.82 -2.007205040e-02 
4.84 -1.773734612e-02 
4.86 -1.561911275e-02 
4.88 -1.370180744e-02 
4.90 -1.197052066e-02 
4.92 -1.041100061e-02 
4.94 -9.009671880e-03 
4.96 -7.753648403e-03 
4.98 -6.630740898e-03 
5.00 -5.629458984e-03 
5.02 -4.739008275e-03 
5.04 -3.949282813e-03 
5.06 -3.250853222e-03 
5.08 -2.634951023e-03 
5.10 -2.093449565e-03 
5.12 -1.618842024e-03 
5.14 -1.204216962e-03 
5.16 -8.432318862e-04 
5.18 -5.300852719e-04 
5.20 -2.594874751e-04 
5.22 -1.944590493e-04 
5.24 -1.810499266e-04 
5.26 -1.684155223e-04 
5.28 -1.565215764e-04 
5.30 -1.453346563e-04 
5.32 -1.348221802e-04 
5.34 -1.249524377e-04 
5.36 -1.156946065e-04 
5.38 -1.070187664e-04 
5.40 -9.889591045e-05 
5.42 -9.129795334e-05 
5.44 -8.419773653e-05 
5.46 -7.756903118e-05 
5.48 -7.138653826e-05 
5.50 -6.562588633e-05 
5.52 -6.026362694e-05 
5.54 -5.527722785e-05 
5.56 -5.064506417e-05 
5.58 -4.634640761e-05 
5.60 -4.236141387e-05 
5.62 -3.867110843e-05 
5.64 -3.525737079e-05 
5.66 -3.210291732e-05 
5.68 -2.919128288e-05 
5.70 -2.650680133e-05 
5.72 -2.403458503e-05 
5.74 -2.176050351e-05 
5.76 -1.967116143e-05 
5.78 -1.775387591e-05 
5.80 -1.599665335e-05 
5.82 -1.438816595e-05 
5.84 -1.291772788e-05 
5.86 -1.157527133e-05 
5.88 -1.035132250e-05 
5.90 -9.236977538e-06 
5.92 -8.223878708e-06 
5.94 -7.304190607e-06 
5.96 -6.470576729e-06 
5.98 -5.716176318e-06 
6.00 -5.034581600e-06