# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 1994--Tersoff-J--Si-C # implementation = 1994--Tersoff-J--Si-C--LAMMPS--ipr1 # composition = C3Si # 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 A15--Cr3Si D0_3--BiF3 L1_2--AuCu3 0.50 nan nan nan 0.52 nan nan nan 0.54 nan nan nan 0.56 nan nan nan 0.58 nan nan nan 0.60 nan nan nan 0.62 nan nan nan 0.64 1.742906394e+03 nan nan 0.66 1.546769669e+03 nan nan 0.68 1.375663779e+03 nan nan 0.70 1.227316095e+03 1.717231047e+03 nan 0.72 1.096195819e+03 1.543171981e+03 1.724908657e+03 0.74 9.838338540e+02 1.394685365e+03 1.558119624e+03 0.76 8.890387466e+02 1.259227075e+03 1.409001532e+03 0.78 8.053359097e+02 1.133325675e+03 1.275095924e+03 0.80 7.291549576e+02 1.020655529e+03 1.156169188e+03 0.82 6.600498299e+02 9.243636213e+02 1.049712100e+03 0.84 5.942411112e+02 8.430756206e+02 9.550075598e+02 0.86 5.312011363e+02 7.701307612e+02 8.675129512e+02 0.88 4.736611070e+02 7.021734260e+02 7.849525126e+02 0.90 4.238635525e+02 6.381689943e+02 7.081314644e+02 0.92 3.824059569e+02 5.786190554e+02 6.392260663e+02 0.94 3.479087057e+02 5.239927040e+02 5.805756643e+02 0.96 3.171124681e+02 4.745349654e+02 5.319731144e+02 0.98 2.871194203e+02 4.296127811e+02 4.875292168e+02 1.00 2.566219268e+02 3.886932892e+02 4.462518822e+02 1.02 2.268427636e+02 3.514320438e+02 4.072692430e+02 1.04 1.989460246e+02 3.181864767e+02 3.712683975e+02 1.06 1.741484133e+02 2.897733855e+02 3.381125879e+02 1.08 1.530086593e+02 2.654295323e+02 3.070622660e+02 1.10 1.363031885e+02 2.442296167e+02 2.785624374e+02 1.12 1.232285445e+02 2.246131313e+02 2.530436352e+02 1.14 1.123849930e+02 2.054155621e+02 2.300149343e+02 1.16 1.024548205e+02 1.867785249e+02 2.087950718e+02 1.18 9.334929931e+01 1.680539030e+02 1.897913590e+02 1.20 8.500123754e+01 1.493542007e+02 1.733764916e+02 1.22 7.734892848e+01 1.311682917e+02 1.596018381e+02 1.24 7.012257493e+01 1.140945040e+02 1.473218602e+02 1.26 6.300147715e+01 9.896568072e+01 1.359739727e+02 1.28 5.609720616e+01 8.643269708e+01 1.253899348e+02 1.30 4.953326510e+01 7.710026932e+01 1.146134559e+02 1.32 4.343684781e+01 7.021130787e+01 1.036276891e+02 1.34 3.793880693e+01 6.411215112e+01 9.270360296e+01 1.36 3.314499254e+01 5.848220078e+01 8.204322322e+01 1.38 2.904229558e+01 5.328719141e+01 7.164365527e+01 1.40 2.562777594e+01 4.849530175e+01 6.175417533e+01 1.42 2.253480580e+01 4.407698200e+01 5.276758696e+01 1.44 1.969579338e+01 4.000479329e+01 4.523035519e+01 1.46 1.714282189e+01 3.625325845e+01 3.952685420e+01 1.48 1.487492719e+01 3.279872332e+01 3.497171791e+01 1.50 1.277119497e+01 2.961922786e+01 3.141994137e+01 1.52 1.077506359e+01 2.669438629e+01 2.836612421e+01 1.54 8.848611892e+00 2.400527575e+01 2.554795048e+01 1.56 7.012732540e+00 2.153416046e+01 2.294881647e+01 1.58 5.224924845e+00 1.921177106e+01 2.055323768e+01 1.60 3.465862786e+00 1.699621174e+01 1.834677515e+01 1.62 1.766232427e+00 1.489349272e+01 1.631596653e+01 1.64 1.635687955e-01 1.290761399e+01 1.444826165e+01 1.66 -1.284759944e+00 1.103298773e+01 1.273196227e+01 1.68 -2.492350032e+00 9.178111138e+00 1.115616581e+01 1.70 -3.356489383e+00 7.347758549e+00 9.710712657e+00 1.72 -3.815509952e+00 5.584411464e+00 8.386136984e+00 1.74 -4.064076658e+00 3.932326685e+00 7.173620752e+00 1.76 -4.258158561e+00 2.437755888e+00 6.064950705e+00 1.78 -4.419419406e+00 1.149041400e+00 5.052478186e+00 1.80 -4.550882038e+00 1.134264800e-01 4.129081575e+00 1.82 -4.661436245e+00 -6.549110245e-01 3.250057877e+00 1.84 -4.756562477e+00 -1.221138075e+00 2.387339181e+00 1.86 -4.834430161e+00 -1.711506962e+00 1.558406994e+00 1.88 -4.893876697e+00 -2.172175413e+00 7.786509143e-01 1.90 -4.934443373e+00 -2.602424908e+00 6.016070363e-02 1.92 -4.956330751e+00 -3.006455705e+00 -5.945252285e-01 1.94 -4.960279098e+00 -3.394761377e+00 -1.205891922e+00 1.96 -4.947391238e+00 -3.756238495e+00 -1.769800709e+00 1.98 -4.912161357e+00 -4.077467441e+00 -2.281770852e+00 2.00 -4.792368465e+00 -4.345121494e+00 -2.739693603e+00 2.02 -4.567879001e+00 -4.546017069e+00 -3.141333734e+00 2.04 -4.239646067e+00 -4.668283020e+00 -3.481653514e+00 2.06 -3.818028841e+00 -4.704659763e+00 -3.751602045e+00 2.08 -3.323134189e+00 -4.658086023e+00 -3.940244482e+00 2.10 -2.783670182e+00 -4.546692605e+00 -4.040556404e+00 2.12 -2.227308955e+00 -4.417100296e+00 -4.075161916e+00 2.14 -1.677134058e+00 -4.302034597e+00 -4.081640089e+00 2.16 -1.161525253e+00 -4.207172654e+00 -4.078120393e+00 2.18 -7.099127717e-01 -4.133915108e+00 -4.065618227e+00 2.20 -3.509839419e-01 -4.063835870e+00 -4.045015633e+00 2.22 -1.099427537e-01 -3.970100809e+00 -4.005039212e+00 2.24 -4.362662039e-03 -3.807799704e+00 -3.916885375e+00 2.26 0.000000000e+00 -3.581105670e+00 -3.776102235e+00 2.28 0.000000000e+00 -3.298076863e+00 -3.580057767e+00 2.30 0.000000000e+00 -2.968638555e+00 -3.327936049e+00 2.32 0.000000000e+00 -2.604350169e+00 -3.021673082e+00 2.34 0.000000000e+00 -2.218119567e+00 -2.666752360e+00 2.36 0.000000000e+00 -1.823867825e+00 -2.272788745e+00 2.38 0.000000000e+00 -1.436143809e+00 -1.853820375e+00 2.40 0.000000000e+00 -1.069680275e+00 -1.428212231e+00 2.42 0.000000000e+00 -7.388730503e-01 -1.018056324e+00 2.44 0.000000000e+00 -4.571551037e-01 -6.479417275e-01 2.46 0.000000000e+00 -2.362341949e-01 -3.429768983e-01 2.48 0.000000000e+00 -8.517509382e-02 -1.259950083e-01 2.50 0.000000000e+00 -9.338321151e-03 -1.397640347e-02 2.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.54 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.56 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.58 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.60 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.62 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.64 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.66 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.68 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.70 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.72 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.74 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.76 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.78 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.80 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.82 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.84 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.86 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.88 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.90 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 2.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.00 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.02 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.04 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.06 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.08 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.10 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.12 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.14 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.16 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.18 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.20 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.22 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.24 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.26 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.28 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.30 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.32 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.34 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.36 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.38 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.40 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.42 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.44 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.46 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.48 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.50 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.54 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.56 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.58 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.60 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.62 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.64 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.66 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.68 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.70 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.72 0.000000000e+00 0.000000000e+00 0.000000000e+00 3.74 0.000000000e+00 0.000000000e+00 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