# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2024--Starikov-S-Grigorev-P-Olsson-P-A-T--W-Mo-Nb
# implementation = 2024--Starikov-S--W-Mo-Nb--LAMMPS--ipr1
# composition = MoNb2
# 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 2024-01-04

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  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  2.088104093e+03 
0.98  1.869014751e+03 
1.00  1.675584988e+03 
1.02  1.505119468e+03 
1.04  1.354282777e+03 
1.06  1.221077762e+03 
1.08  1.103643500e+03 
1.10  1.000143914e+03 
1.12  9.085822753e+02 
1.14  8.269744957e+02 
1.16  7.540127112e+02 
1.18  6.887731800e+02 
1.20  6.304004546e+02 
1.22  5.784985663e+02 
1.24  5.323527396e+02 
1.26  4.912549176e+02 
1.28  4.546152713e+02 
1.30  4.217981902e+02 
1.32  3.925729333e+02 
1.34  3.665148593e+02 
1.36  3.431512609e+02 
1.38  3.223094934e+02 
1.40  3.036749430e+02 
1.42  2.868926892e+02 
1.44  2.718375378e+02 
1.46  2.583221717e+02 
1.48  2.464785110e+02 
1.50  2.357509355e+02 
1.52  2.260455243e+02 
1.54  2.173546785e+02 
1.56  2.096255980e+02 
1.58  2.027173297e+02 
1.60  1.964813512e+02 
1.62  1.908946010e+02 
1.64  1.859169074e+02 
1.66  1.814399289e+02 
1.68  1.773808100e+02 
1.70  1.737829170e+02 
1.72  1.706784576e+02 
1.74  1.679852559e+02 
1.76  1.656016667e+02 
1.78  1.634795054e+02 
1.80  1.615996864e+02 
1.82  1.598783570e+02 
1.84  1.583200864e+02 
1.86  1.569164841e+02 
1.88  1.556408080e+02 
1.90  1.544856735e+02 
1.92  1.534438878e+02 
1.94  1.525046548e+02 
1.96  1.516563675e+02 
1.98  1.508833203e+02 
2.00  1.501877723e+02 
2.02  1.494812207e+02 
2.04  1.489223152e+02 
2.06  1.484112464e+02 
2.08  1.479325200e+02 
2.10  1.344151818e+02 
2.12  1.088777444e+02 
2.14  7.696780934e+01 
2.16  5.201386391e+01 
2.18  3.380887603e+01 
2.20  2.158262432e+01 
2.22  1.320376735e+01 
2.24  8.063063549e+00 
2.26  5.150195740e+00 
2.28  3.321657871e+00 
2.30  1.667703316e+00 
2.32 -2.199228272e-01 
2.34 -2.108235404e+00 
2.36 -3.644503133e+00 
2.38 -4.647203813e+00 
2.40 -5.128585572e+00 
2.42 -5.314814388e+00 
2.44 -5.526046773e+00 
2.46 -5.671905746e+00 
2.48 -5.814845513e+00 
2.50 -5.934851268e+00 
2.52 -6.057446197e+00 
2.54 -6.162082948e+00 
2.56 -6.271751539e+00 
2.58 -6.378434835e+00 
2.60 -6.467573910e+00 
2.62 -6.531963275e+00 
2.64 -6.574236403e+00 
2.66 -6.601635856e+00 
2.68 -6.613690577e+00 
2.70 -6.618738205e+00 
2.72 -6.616885471e+00 
2.74 -6.608117697e+00 
2.76 -6.589103122e+00 
2.78 -6.557985454e+00 
2.80 -6.515189795e+00 
2.82 -6.463598181e+00 
2.84 -6.404593794e+00 
2.86 -6.332528793e+00 
2.88 -6.242615553e+00 
2.90 -6.146990510e+00 
2.92 -6.070608683e+00 
2.94 -6.000348938e+00 
2.96 -5.917970065e+00 
2.98 -5.846977074e+00 
3.00 -5.787948212e+00 
3.02 -5.738524738e+00 
3.04 -5.696107594e+00 
3.06 -5.654254007e+00 
3.08 -5.602352020e+00 
3.10 -5.535159544e+00 
3.12 -5.449549349e+00 
3.14 -5.348541163e+00 
3.16 -5.236129425e+00 
3.18 -5.114378020e+00 
3.20 -4.996078760e+00 
3.22 -4.902327537e+00 
3.24 -4.853913958e+00 
3.26 -4.827686190e+00 
3.28 -4.800858809e+00 
3.30 -4.768126085e+00 
3.32 -4.725232908e+00 
3.34 -4.669283282e+00 
3.36 -4.597654861e+00 
3.38 -4.507431006e+00 
3.40 -4.396091323e+00 
3.42 -4.265544934e+00 
3.44 -4.121036279e+00 
3.46 -3.968465249e+00 
3.48 -3.814481270e+00 
3.50 -3.666634445e+00 
3.52 -3.534354718e+00 
3.54 -3.423718178e+00 
3.56 -3.336572287e+00 
3.58 -3.270724699e+00 
3.60 -3.219558343e+00 
3.62 -3.175345363e+00 
3.64 -3.130454011e+00 
3.66 -3.081936262e+00 
3.68 -3.029126317e+00 
3.70 -2.970074804e+00 
3.72 -2.902893618e+00 
3.74 -2.829219814e+00 
3.76 -2.755262808e+00 
3.78 -2.687786497e+00 
3.80 -2.633246489e+00 
3.82 -2.577204911e+00 
3.84 -2.512974811e+00 
3.86 -2.441779720e+00 
3.88 -2.364769802e+00 
3.90 -2.282768361e+00 
3.92 -2.196580102e+00 
3.94 -2.107393078e+00 
3.96 -2.017188155e+00 
3.98 -1.928019318e+00 
4.00 -1.841939530e+00 
4.02 -1.761057871e+00 
4.04 -1.687542245e+00 
4.06 -1.623537618e+00 
4.08 -1.568927862e+00 
4.10 -1.521196739e+00 
4.12 -1.478761853e+00 
4.14 -1.441038267e+00 
4.16 -1.407560771e+00 
4.18 -1.378033723e+00 
4.20 -1.352560425e+00 
4.22 -1.332553436e+00 
4.24 -1.318070317e+00 
4.26 -1.307961690e+00 
4.28 -1.300933808e+00 
4.30 -1.295580788e+00 
4.32 -1.290399663e+00 
4.34 -1.284099355e+00 
4.36 -1.276895666e+00 
4.38 -1.269539376e+00 
4.40 -1.262854148e+00 
4.42 -1.257734145e+00 
4.44 -1.255128118e+00 
4.46 -1.255429088e+00 
4.48 -1.257596886e+00 
4.50 -1.260522504e+00 
4.52 -1.263085443e+00 
4.54 -1.264148858e+00 
4.56 -1.262563484e+00 
4.58 -1.257608925e+00 
4.60 -1.249269644e+00 
4.62 -1.237543660e+00 
4.64 -1.222410859e+00 
4.66 -1.203870803e+00 
4.68 -1.181953557e+00 
4.70 -1.156647263e+00 
4.72 -1.127901040e+00 
4.74 -1.095877262e+00 
4.76 -1.061604006e+00 
4.78 -1.026380541e+00 
4.80 -9.915149558e-01 
4.82 -9.582299615e-01 
4.84 -9.276935726e-01 
4.86 -9.010764345e-01 
4.88 -8.786522164e-01 
4.90 -8.587681554e-01 
4.92 -8.397324215e-01 
4.94 -8.215491777e-01 
4.96 -8.049630134e-01 
4.98 -7.908593836e-01 
5.00 -7.803016091e-01 
5.02 -7.758013784e-01 
5.04 -7.798170009e-01 
5.06 -7.903548692e-01 
5.08 -8.045156849e-01 
5.10 -8.196336268e-01 
5.12 -8.333337630e-01 
5.14 -8.433416356e-01 
5.16 -8.479674824e-01 
5.18 -8.479421967e-01 
5.20 -8.442331708e-01 
5.22 -8.377556404e-01 
5.24 -8.294338818e-01 
5.26 -8.202459380e-01 
5.28 -8.111279472e-01 
5.30 -8.028326431e-01 
5.32 -7.961370395e-01 
5.34 -7.918447771e-01 
5.36 -7.907428584e-01 
5.38 -7.920820818e-01 
5.40 -7.911130829e-01 
5.42 -7.873902387e-01 
5.44 -7.811257933e-01 
5.46 -7.725330880e-01 
5.48 -7.618113501e-01 
5.50 -7.491537325e-01 
5.52 -7.347545218e-01 
5.54 -7.188577389e-01 
5.56 -7.022080025e-01 
5.58 -6.859242940e-01 
5.60 -6.712158077e-01 
5.62 -6.593536615e-01 
5.64 -6.516137633e-01 
5.66 -6.491840137e-01 
5.68 -6.526263096e-01 
5.70 -6.604349018e-01 
5.72 -6.706692264e-01 
5.74 -6.816362831e-01 
5.76 -6.919276882e-01 
5.78 -7.003895009e-01 
5.80 -7.060117252e-01 
5.82 -7.082551096e-01 
5.84 -7.074151495e-01 
5.86 -7.038104264e-01 
5.88 -6.978150941e-01 
5.90 -6.899134460e-01 
5.92 -6.807065249e-01 
5.94 -6.708520080e-01 
5.96 -6.600752111e-01 
5.98 -6.471368980e-01 
6.00 -6.306405730e-01