# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom).
# potential = 2013--Hale-L-M-Wong-B-M-Zimmerman-J-A-Zhou-X-W--Pd-Ag-H-Hybrid
# implementation = 2013--Hale-L-M--Pd-Ag-H-Hybrid--LAMMPS--ipr1
# composition = AgPd2
# 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  6.593930818e+03 
0.94  6.101029164e+03 
0.96  5.645465697e+03 
0.98  5.225176728e+03 
1.00  4.840103749e+03 
1.02  4.487681755e+03 
1.04  4.163040520e+03 
1.06  3.862488181e+03 
1.08  3.582876070e+03 
1.10  3.321949382e+03 
1.12  3.077565407e+03 
1.14  2.847331409e+03 
1.16  2.628738623e+03 
1.18  2.420334204e+03 
1.20  2.221051686e+03 
1.22  2.031015778e+03 
1.24  1.851313822e+03 
1.26  1.680772030e+03 
1.28  1.520088848e+03 
1.30  1.369246891e+03 
1.32  1.227567553e+03 
1.34  1.094597511e+03 
1.36  9.696258591e+02 
1.38  8.525193403e+02 
1.40  7.430808870e+02 
1.42  6.400624556e+02 
1.44  5.431709560e+02 
1.46  4.524515443e+02 
1.48  3.671422403e+02 
1.50  2.865503353e+02 
1.52  2.107355662e+02 
1.54  1.398462408e+02 
1.56  7.303067870e+01 
1.58  4.063285811e+01 
1.60  3.300500093e+01 
1.62  2.978502315e+01 
1.64  2.724544173e+01 
1.66  2.491650540e+01 
1.68  2.277636505e+01 
1.70  2.081494166e+01 
1.72  1.901336529e+01 
1.74  1.735426964e+01 
1.76  1.582215517e+01 
1.78  1.439609131e+01 
1.80  1.307078249e+01 
1.82  1.184554163e+01 
1.84  1.071076073e+01 
1.86  9.661368853e+00 
1.88  8.690319977e+00 
1.90  7.783528486e+00 
1.92  6.942334538e+00 
1.94  6.159156965e+00 
1.96  5.428599278e+00 
1.98  4.745711171e+00 
2.00  4.106513878e+00 
2.02  3.508329819e+00 
2.04  2.949113239e+00 
2.06  2.424269011e+00 
2.08  1.925266950e+00 
2.10  1.457669886e+00 
2.12  1.013174968e+00 
2.14  5.928158044e-01 
2.16  2.031211054e-01 
2.18 -1.588703593e-01 
2.20 -4.942179960e-01 
2.22 -8.039472666e-01 
2.24 -1.089052358e+00 
2.26 -1.350529125e+00 
2.28 -1.589513868e+00 
2.30 -1.807671758e+00 
2.32 -2.007507763e+00 
2.34 -2.187474908e+00 
2.36 -2.348921811e+00 
2.38 -2.492738873e+00 
2.40 -2.619823314e+00 
2.42 -2.731081606e+00 
2.44 -2.827421208e+00 
2.46 -2.909738146e+00 
2.48 -2.978905439e+00 
2.50 -3.035760483e+00 
2.52 -3.081084748e+00 
2.54 -3.115566433e+00 
2.56 -3.139789154e+00 
2.58 -3.154265072e+00 
2.60 -3.159499889e+00 
2.62 -3.156107860e+00 
2.64 -3.144995329e+00 
2.66 -3.127624959e+00 
2.68 -3.105414366e+00 
2.70 -3.075177563e+00 
2.72 -3.038322329e+00 
2.74 -2.995854413e+00 
2.76 -2.949469355e+00 
2.78 -2.902123033e+00 
2.80 -2.855973126e+00 
2.82 -2.802758721e+00 
2.84 -2.745276691e+00 
2.86 -2.684169887e+00 
2.88 -2.620088655e+00 
2.90 -2.553697051e+00 
2.92 -2.485654956e+00 
2.94 -2.416591068e+00 
2.96 -2.347076004e+00 
2.98 -2.277602882e+00 
3.00 -2.208578872e+00 
3.02 -2.140326329e+00 
3.04 -2.073089467e+00 
3.06 -2.007043618e+00 
3.08 -1.942306885e+00 
3.10 -1.878956274e+00 
3.12 -1.817050813e+00 
3.14 -1.756663115e+00 
3.16 -1.697917835e+00 
3.18 -1.641033737e+00 
3.20 -1.586370446e+00 
3.22 -1.534472430e+00 
3.24 -1.486103606e+00 
3.26 -1.442268581e+00 
3.28 -1.403396747e+00 
3.30 -1.364274307e+00 
3.32 -1.326234230e+00 
3.34 -1.289284512e+00 
3.36 -1.253445064e+00 
3.38 -1.218734808e+00 
3.40 -1.185169518e+00 
3.42 -1.152758545e+00 
3.44 -1.121501199e+00 
3.46 -1.091383903e+00 
3.48 -1.062379130e+00 
3.50 -1.034446558e+00 
3.52 -1.007536046e+00 
3.54 -9.815914972e-01 
3.56 -9.565545910e-01 
3.58 -9.323676801e-01 
3.60 -9.089756240e-01 
3.62 -8.863266766e-01 
3.64 -8.643727238e-01 
3.66 -8.430691742e-01 
3.68 -8.223747281e-01 
3.70 -8.022508295e-01 
3.72 -7.826605179e-01 
3.74 -7.635683328e-01 
3.76 -7.449407002e-01 
3.78 -7.267462835e-01 
3.80 -7.089562800e-01 
3.82 -6.915446415e-01 
3.84 -6.744882166e-01 
3.86 -6.577668253e-01 
3.88 -6.413632355e-01 
3.90 -6.252630258e-01 
3.92 -6.094544095e-01 
3.94 -5.939279546e-01 
3.96 -5.786762067e-01 
3.98 -5.636933327e-01 
4.00 -5.489746304e-01 
4.02 -5.345161029e-01 
4.04 -5.203139835e-01 
4.06 -5.063642984e-01 
4.08 -4.926624974e-01 
4.10 -4.792031147e-01 
4.12 -4.659795630e-01 
4.14 -4.529839996e-01 
4.16 -4.402073128e-01 
4.18 -4.276392587e-01 
4.20 -4.152686275e-01 
4.22 -4.030836258e-01 
4.24 -3.910721970e-01 
4.26 -3.792224771e-01 
4.28 -3.675232295e-01 
4.30 -3.559641687e-01 
4.32 -3.445362913e-01 
4.34 -3.332320398e-01 
4.36 -3.220452870e-01 
4.38 -3.109712248e-01 
4.40 -3.000061378e-01 
4.42 -2.891471263e-01 
4.44 -2.783919406e-01 
4.46 -2.677392207e-01 
4.48 -2.571894484e-01 
4.50 -2.467471564e-01 
4.52 -2.364251155e-01 
4.54 -2.262515079e-01 
4.56 -2.162813854e-01 
4.58 -2.066140278e-01 
4.60 -1.974182551e-01 
4.62 -1.889679201e-01 
4.64 -1.811831552e-01 
4.66 -1.729476231e-01 
4.68 -1.647947335e-01 
4.70 -1.567381960e-01 
4.72 -1.487910329e-01 
4.74 -1.409665888e-01 
4.76 -1.332783077e-01 
4.78 -1.257394830e-01 
4.80 -1.183629807e-01 
4.82 -1.111609401e-01 
4.84 -1.041444620e-01 
4.86 -9.732329388e-02 
4.88 -9.070552293e-02 
4.90 -8.429729200e-02 
4.92 -7.810255955e-02 
4.94 -7.212292140e-02 
4.96 -6.635751824e-02 
4.98 -6.080307447e-02 
5.00 -5.545402180e-02 
5.02 -5.030327483e-02 
5.04 -4.534204308e-02 
5.06 -4.056043865e-02 
5.08 -3.594884513e-02 
5.10 -3.149838003e-02 
5.12 -2.720165028e-02 
5.14 -2.306008966e-02 
5.16 -1.908207801e-02 
5.18 -1.528490213e-02 
5.20 -1.169736122e-02 
5.22 -8.362529571e-03 
5.24 -5.340654228e-03 
5.26 -2.712147364e-03 
5.28 -5.806034932e-04 
5.30  9.242849334e-04 
5.32  1.644171869e-03 
5.34  1.389403518e-03 
5.36  7.981236817e-04 
5.38  7.251539611e-04 
5.40  6.577636292e-04 
5.42  5.928560251e-04 
5.44  5.306089172e-04 
5.46  4.712281666e-04 
5.48  4.149399255e-04 
5.50  3.619795237e-04 
5.52  3.125773706e-04 
5.54  2.669427094e-04 
5.56  2.252465645e-04 
5.58  1.876056358e-04 
5.60  1.540690032e-04 
5.62  1.246093565e-04 
5.64  9.911997719e-05 
5.66  7.741787710e-05 
5.68  5.925269613e-05 
5.70  4.432020004e-05 
5.72  3.227865171e-05 
5.74  2.276618705e-05 
5.76  1.541744795e-05 
5.78  9.878097168e-06 
5.80  5.816363829e-06 
5.82  2.931261828e-06 
5.84  9.575853228e-07 
5.86 -3.319210666e-07 
5.88 -1.126667851e-06 
5.90 -1.579963724e-06 
5.92 -1.811816925e-06 
5.94 -1.912313020e-06 
5.96 -1.945165029e-06 
5.98 -1.951429216e-06 
6.00 -1.951366667e-06