# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr
# implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1
# composition = MoTa2
# 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 2024-04-11

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  nan             
1.12  nan             
1.14  4.443812492e+02 
1.16  4.104909383e+02 
1.18  3.792716330e+02 
1.20  3.504946861e+02 
1.22  3.239572583e+02 
1.24  2.994755197e+02 
1.26  2.768807435e+02 
1.28  2.560178243e+02 
1.30  2.367446799e+02 
1.32  2.189313474e+02 
1.34  2.024584420e+02 
1.36  1.872155729e+02 
1.38  1.731005986e+02 
1.40  1.600198171e+02 
1.42  1.478882425e+02 
1.44  1.366291319e+02 
1.46  1.261727374e+02 
1.48  1.164549481e+02 
1.50  1.074165211e+02 
1.52  9.900313531e+01 
1.54  9.116595153e+01 
1.56  8.386206802e+01 
1.58  7.705436791e+01 
1.60  7.071063562e+01 
1.62  6.480222276e+01 
1.64  5.930272179e+01 
1.66  5.418700916e+01 
1.68  4.943077374e+01 
1.70  4.501042676e+01 
1.72  4.090319617e+01 
1.74  3.708724405e+01 
1.76  3.354174483e+01 
1.78  3.024753317e+01 
1.80  2.719699062e+01 
1.82  2.437601455e+01 
1.84  2.176740986e+01 
1.86  1.935728413e+01 
1.88  1.713275039e+01 
1.90  1.508056985e+01 
1.92  1.318851816e+01 
1.94  1.144516583e+01 
1.96  9.839718428e+00 
1.98  8.361937868e+00 
2.00  7.002135497e+00 
2.02  5.751209275e+00 
2.04  4.600690944e+00 
2.06  3.542773901e+00 
2.08  2.570308095e+00 
2.10  1.676768270e+00 
2.12  8.562141960e-01 
2.14  1.032585519e-01 
2.16 -5.869559792e-01 
2.18 -1.218782240e+00 
2.20 -1.796112378e+00 
2.22 -2.322449102e+00 
2.24 -2.801002609e+00 
2.26 -3.234801533e+00 
2.28 -3.626800519e+00 
2.30 -3.979965517e+00 
2.32 -4.297320306e+00 
2.34 -4.581944218e+00 
2.36 -4.836921261e+00 
2.38 -5.065252947e+00 
2.40 -5.269756960e+00 
2.42 -5.452977133e+00 
2.44 -5.617125122e+00 
2.46 -5.763916279e+00 
2.48 -5.894751189e+00 
2.50 -6.011221911e+00 
2.52 -6.114622498e+00 
2.54 -6.206010603e+00 
2.56 -6.286277848e+00 
2.58 -6.356203656e+00 
2.60 -6.416491912e+00 
2.62 -6.467608713e+00 
2.64 -6.509604722e+00 
2.66 -6.542581351e+00 
2.68 -6.566653115e+00 
2.70 -6.582014419e+00 
2.72 -6.589054460e+00 
2.74 -6.588159948e+00 
2.76 -6.579699170e+00 
2.78 -6.564012332e+00 
2.80 -6.541405360e+00 
2.82 -6.512146692e+00 
2.84 -6.476466556e+00 
2.86 -6.434556878e+00 
2.88 -6.386495006e+00 
2.90 -6.332222618e+00 
2.92 -6.271676195e+00 
2.94 -6.204796329e+00 
2.96 -6.131524983e+00 
2.98 -6.051802983e+00 
3.00 -5.965568231e+00 
3.02 -5.872755268e+00 
3.04 -5.773296796e+00 
3.06 -5.667127642e+00 
3.08 -5.554191479e+00 
3.10 -5.434450411e+00 
3.12 -5.307897377e+00 
3.14 -5.174571135e+00 
3.16 -5.034573372e+00 
3.18 -4.888087224e+00 
3.20 -4.735396037e+00 
3.22 -4.576900767e+00 
3.24 -4.413133967e+00 
3.26 -4.244768033e+00 
3.28 -4.072615475e+00 
3.30 -3.897619500e+00 
3.32 -3.720834162e+00 
3.34 -3.543394634e+00 
3.36 -3.366479489e+00 
3.38 -3.191267971e+00 
3.40 -3.018895858e+00 
3.42 -2.850413555e+00 
3.44 -2.686749595e+00 
3.46 -2.528681923e+00 
3.48 -2.376818449e+00 
3.50 -2.231587461e+00 
3.52 -2.093237756e+00 
3.54 -1.961847721e+00 
3.56 -1.837342142e+00 
3.58 -1.719515123e+00 
3.60 -1.608057306e+00 
3.62 -1.502585465e+00 
3.64 -1.402672611e+00 
3.66 -1.307876913e+00 
3.68 -1.217767948e+00 
3.70 -1.131949128e+00 
3.72 -1.050075370e+00 
3.74 -9.718654155e-01 
3.76 -8.971084687e-01 
3.78 -8.256651121e-01 
3.80 -7.574628150e-01 
3.82 -6.924866849e-01 
3.84 -6.307664659e-01 
3.86 -5.723610886e-01 
3.88 -5.173422369e-01 
3.90 -4.657784703e-01 
3.92 -4.177212923e-01 
3.94 -3.731941849e-01 
3.96 -3.321852019e-01 
3.98 -2.946433887e-01 
4.00 -2.604784884e-01 
4.02 -2.295639979e-01 
4.04 -2.017434218e-01 
4.06 -1.768355420e-01 
4.08 -1.546415733e-01 
4.10 -1.349522565e-01 
4.12 -1.175543439e-01 
4.14 -1.022361777e-01 
4.16 -8.879221643e-02 
4.18 -7.702648184e-02 
4.20 -6.675498907e-02 
4.22 -5.780727760e-02 
4.24 -5.002718843e-02 
4.26 -4.327303937e-02 
4.28 -3.741734311e-02 
4.30 -3.234619435e-02 
4.32 -2.795844924e-02 
4.34 -2.416475929e-02 
4.36 -2.088654147e-02 
4.38 -1.805493205e-02 
4.40 -1.560979506e-02 
4.42 -1.349876202e-02 
4.44 -1.167626933e-02 
4.46 -1.010256275e-02 
4.48 -8.743707066e-03 
4.50 -7.570332731e-03 
4.52 -6.556993524e-03 
4.54 -5.681684670e-03 
4.56 -4.925404360e-03 
4.58 -4.271760845e-03 
4.60 -3.706624250e-03 
4.62 -3.217820458e-03 
4.64 -2.794863613e-03 
4.66 -2.428723395e-03 
4.68 -2.111623238e-03 
4.70 -1.836865834e-03 
4.72 -1.598682516e-03 
4.74 -1.392103450e-03 
4.76 -1.212845887e-03 
4.78 -1.057218031e-03 
4.80 -9.220362261e-04 
4.82 -8.045546457e-04 
4.84 -7.024031681e-04 
4.86 -6.135357199e-04 
4.88 -5.361850445e-04 
4.90 -4.688240117e-04 
4.92 -4.101323740e-04 
4.94 -3.589681943e-04 
4.96 -3.143432841e-04 
4.98 -2.754020825e-04 
5.00 -2.414034882e-04 
5.02 -2.117052246e-04 
5.04 -1.857503821e-04 
5.06 -1.630558272e-04 
5.08 -1.432022175e-04 
5.10 -1.258253938e-04 
5.12 -1.106089587e-04 
5.14 -9.727787297e-05 
5.16 -8.559292879e-05 
5.18 -7.534597706e-05 
5.20 -6.635580388e-05 
5.22 -5.846456626e-05 
5.24 -5.153470972e-05 
5.26 -4.544630118e-05 
5.28 -4.009472020e-05 
5.30 -3.538865929e-05 
5.32 -3.124839118e-05 
5.34 -2.760426651e-05 
5.36 -2.439541081e-05 
5.38 -2.156859365e-05 
5.40 -1.907724676e-05 
5.42 -1.688061113e-05 
5.44 -1.494299570e-05 
5.46 -1.323313278e-05 
5.48 -1.172361726e-05 
5.50 -1.039041855e-05 
5.52 -9.212455567e-06 
5.54 -8.171226375e-06 
5.56 -7.250485478e-06 
5.58 -6.435962326e-06 
5.60 -5.715115740e-06 
5.62 -5.076919567e-06 
5.64 -4.511675487e-06 
5.66 -4.010849466e-06 
5.68 -3.566928810e-06 
5.70 -3.173297156e-06 
5.72 -2.824125105e-06 
5.74 -2.514274501e-06 
5.76 -2.239214609e-06 
5.78 -1.994948684e-06 
5.80 -1.777949615e-06 
5.82 -1.585103499e-06 
5.84 -1.413660141e-06 
5.86 -1.261189621e-06 
5.88 -1.125544157e-06 
5.90 -1.004824614e-06 
5.92 -8.973510723e-07 
5.94 -8.016369596e-07 
5.96 -7.163663011e-07 
5.98 -6.403737057e-07 
6.00 -5.726267524e-07