# 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 = Al2Fe
# 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  1.296153044e+02 
1.16  1.195675502e+02 
1.18  1.103304906e+02 
1.20  1.018245195e+02 
1.22  9.397901747e+01 
1.24  8.673185113e+01 
1.26  8.003003502e+01 
1.28  7.382878105e+01 
1.30  6.808856372e+01 
1.32  6.277258010e+01 
1.34  5.784621672e+01 
1.36  5.327795605e+01 
1.38  4.904002501e+01 
1.40  4.510788687e+01 
1.42  4.145898342e+01 
1.44  3.807144645e+01 
1.46  3.492401564e+01 
1.48  3.199676044e+01 
1.50  2.927448096e+01 
1.52  2.674734872e+01 
1.54  2.440306711e+01 
1.56  2.223042777e+01 
1.58  2.021855752e+01 
1.60  1.835662135e+01 
1.62  1.663389295e+01 
1.64  1.503989635e+01 
1.66  1.356455084e+01 
1.68  1.219839433e+01 
1.70  1.093287346e+01 
1.72  9.760510276e+00 
1.74  8.674776610e+00 
1.76  7.669760122e+00 
1.78  6.739885066e+00 
1.80  5.879858882e+00 
1.82  5.084791592e+00 
1.84  4.350313075e+00 
1.86  3.672564609e+00 
1.88  3.048055953e+00 
1.90  2.473449643e+00 
1.92  1.945349117e+00 
1.94  1.460162277e+00 
1.96  1.014092609e+00 
1.98  6.032669163e-01 
2.00  2.239543127e-01 
2.02 -1.272035093e-01 
2.04 -4.530295661e-01 
2.06 -7.557623927e-01 
2.08 -1.037117828e+00 
2.10 -1.298420485e+00 
2.12 -1.540752543e+00 
2.14 -1.765079284e+00 
2.16 -1.972329889e+00 
2.18 -2.163429473e+00 
2.20 -2.339292240e+00 
2.22 -2.500794799e+00 
2.24 -2.648748945e+00 
2.26 -2.783885374e+00 
2.28 -2.906849785e+00 
2.30 -3.018206801e+00 
2.32 -3.118447614e+00 
2.34 -3.207999647e+00 
2.36 -3.287239760e+00 
2.38 -3.356512652e+00 
2.40 -3.416155171e+00 
2.42 -3.466963333e+00 
2.44 -3.511082372e+00 
2.46 -3.548412746e+00 
2.48 -3.578762623e+00 
2.50 -3.602154754e+00 
2.52 -3.618802970e+00 
2.54 -3.629082175e+00 
2.56 -3.633493683e+00 
2.58 -3.632632645e+00 
2.60 -3.627174786e+00 
2.62 -3.617770894e+00 
2.64 -3.604897773e+00 
2.66 -3.588946356e+00 
2.68 -3.570234543e+00 
2.70 -3.548991875e+00 
2.72 -3.525356978e+00 
2.74 -3.499386441e+00 
2.76 -3.471070768e+00 
2.78 -3.440352423e+00 
2.80 -3.407142491e+00 
2.82 -3.371334219e+00 
2.84 -3.332813856e+00 
2.86 -3.291469692e+00 
2.88 -3.247200801e+00 
2.90 -3.199926784e+00 
2.92 -3.149599529e+00 
2.94 -3.096217381e+00 
2.96 -3.039841268e+00 
2.98 -2.980611054e+00 
3.00 -2.918758956e+00 
3.02 -2.854615735e+00 
3.04 -2.788605349e+00 
3.06 -2.721225593e+00 
3.08 -2.653015374e+00 
3.10 -2.584514179e+00 
3.12 -2.516221626e+00 
3.14 -2.448565850e+00 
3.16 -2.381886380e+00 
3.18 -2.316432996e+00 
3.20 -2.252377386e+00 
3.22 -2.189832109e+00 
3.24 -2.128870959e+00 
3.26 -2.069546206e+00 
3.28 -2.011900221e+00 
3.30 -1.955971040e+00 
3.32 -1.901792820e+00 
3.34 -1.849392949e+00 
3.36 -1.798787751e+00 
3.38 -1.749978446e+00 
3.40 -1.702948495e+00 
3.42 -1.657662911e+00 
3.44 -1.614069409e+00 
3.46 -1.572101147e+00 
3.48 -1.531680346e+00 
3.50 -1.492722239e+00 
3.52 -1.455138825e+00 
3.54 -1.418842090e+00 
3.56 -1.383746515e+00 
3.58 -1.349770846e+00 
3.60 -1.316839180e+00 
3.62 -1.284881494e+00 
3.64 -1.253833723e+00 
3.66 -1.223637545e+00 
3.68 -1.194239944e+00 
3.70 -1.165592665e+00 
3.72 -1.137651603e+00 
3.74 -1.110376169e+00 
3.76 -1.083728668e+00 
3.78 -1.057673708e+00 
3.80 -1.032177631e+00 
3.82 -1.007207995e+00 
3.84 -9.827330917e-01 
3.86 -9.587215113e-01 
3.88 -9.351417544e-01 
3.90 -9.119618988e-01 
3.92 -8.891493181e-01 
3.94 -8.666705247e-01 
3.96 -8.444910065e-01 
3.98 -8.225752835e-01 
4.00 -8.008870565e-01 
4.02 -7.793895472e-01 
4.04 -7.580460545e-01 
4.06 -7.368207665e-01 
4.08 -7.156798584e-01 
4.10 -6.945928819e-01 
4.12 -6.735345252e-01 
4.14 -6.524864862e-01 
4.16 -6.314396615e-01 
4.18 -6.103962739e-01 
4.20 -5.893718157e-01 
4.22 -5.683965234e-01 
4.24 -5.475160851e-01 
4.26 -5.267912983e-01 
4.28 -5.062964674e-01 
4.30 -4.861164679e-01 
4.32 -4.663425873e-01 
4.34 -4.470674518e-01 
4.36 -4.283795257e-01 
4.38 -4.103577645e-01 
4.40 -3.930670058e-01 
4.42 -3.765545676e-01 
4.44 -3.608483354e-01 
4.46 -3.459563932e-01 
4.48 -3.318680442e-01 
4.50 -3.185559397e-01 
4.52 -3.059788772e-01 
4.54 -2.940849328e-01 
4.56 -2.828145892e-01 
4.58 -2.721036755e-01 
4.60 -2.618858827e-01 
4.62 -2.520943822e-01 
4.64 -2.426640881e-01 
4.66 -2.335336532e-01 
4.68 -2.246451512e-01 
4.70 -2.159449447e-01 
4.72 -2.073843767e-01 
4.74 -1.989203501e-01 
4.76 -1.905158615e-01 
4.78 -1.821405280e-01 
4.80 -1.737711046e-01 
4.82 -1.653920674e-01 
4.84 -1.569959871e-01 
4.86 -1.485839504e-01 
4.88 -1.401657063e-01 
4.90 -1.317595533e-01 
4.92 -1.233918785e-01 
4.94 -1.150962924e-01 
4.96 -1.069123444e-01 
4.98 -9.888384821e-02 
5.00 -9.105689773e-02 
5.02 -8.347770023e-02 
5.04 -7.619038652e-02 
5.06 -6.923496960e-02 
5.08 -6.264561084e-02 
5.10 -5.644931869e-02 
5.12 -5.066515379e-02 
5.14 -4.530395795e-02 
5.16 -4.036856995e-02 
5.18 -3.585444940e-02 
5.20 -3.175060307e-02 
5.22 -2.804069920e-02 
5.24 -2.470426085e-02 
5.26 -2.171784571e-02 
5.28 -1.905614282e-02 
5.30 -1.669293276e-02 
5.32 -1.460189891e-02 
5.34 -1.275727279e-02 
5.36 -1.113431630e-02 
5.38 -9.709258993e-03 
5.40 -8.460426102e-03 
5.42 -7.368098776e-03 
5.44 -6.414164794e-03 
5.46 -5.582164789e-03 
5.48 -4.857270989e-03 
5.50 -4.226220377e-03 
5.52 -3.677219083e-03 
5.54 -3.199830528e-03 
5.56 -2.784856409e-03 
5.58 -2.424216882e-03 
5.60 -2.110834257e-03 
5.62 -1.838522946e-03 
5.64 -1.601887255e-03 
5.66 -1.396227828e-03 
5.68 -1.217456946e-03 
5.70 -1.062022526e-03 
5.72 -9.268403994e-04 
5.74 -8.092343327e-04 
5.76 -7.068831346e-04 
5.78 -6.177742066e-04 
5.80 -5.401628763e-04 
5.82 -4.725368877e-04 
5.84 -4.135854617e-04 
5.86 -3.621723850e-04 
5.88 -3.173126389e-04 
5.90 -2.781521235e-04 
5.92 -2.439500856e-04 
5.94 -2.140638998e-04 
5.96 -1.879358959e-04 
5.98 -1.650819614e-04 
6.00 -1.450816835e-04