# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2016--Nichol-A-Ackland-G-J--Na # implementation = 2016--Nichol-A--Na--LAMMPS--ipr2 # NOTE: These values only provide a look at the purely pair interaction # of the potential and therefore exclude multi-body interactions. # Calculations from the NIST Interatomic Potential Repository Project: # http://www.ctcms.nist.gov/potentials/ # Table generated 2022-05-24 r Na Na 0.02 7.386236336e+04 0.04 3.184992908e+04 0.06 1.855984958e+04 0.08 1.229502750e+04 0.10 8.758456644e+03 0.12 6.540269308e+03 0.14 5.048574282e+03 0.16 3.994413947e+03 0.18 3.221331034e+03 0.20 2.637897682e+03 0.22 2.187446974e+03 0.24 1.833169207e+03 0.26 1.550221019e+03 0.28 1.321295332e+03 0.30 1.134010392e+03 0.32 9.793063584e+02 0.34 8.504252478e+02 0.36 7.422418047e+02 0.38 6.508126448e+02 0.40 5.730652213e+02 0.42 5.065787324e+02 0.44 4.494269159e+02 0.46 4.000633801e+02 0.48 3.572367247e+02 0.50 3.199268842e+02 0.52 2.872968178e+02 0.54 2.586554569e+02 0.56 2.334290081e+02 0.58 2.111385347e+02 0.60 1.913823008e+02 0.62 1.738217635e+02 0.64 1.581703851e+02 0.66 1.441846411e+02 0.68 1.316567498e+02 0.70 1.204087645e+02 0.72 1.102877454e+02 0.74 1.011617980e+02 0.76 9.291680595e+01 0.78 8.545372550e+01 0.80 7.868633673e+01 0.82 7.253936649e+01 0.84 6.694691610e+01 0.86 6.185113986e+01 0.88 5.720113037e+01 0.90 5.295197548e+01 0.92 4.906395777e+01 0.94 4.550187318e+01 0.96 4.223444911e+01 0.98 3.923384628e+01 1.00 3.647523109e+01 1.02 3.393640740e+01 1.04 3.159749885e+01 1.06 2.944067389e+01 1.08 2.744990739e+01 1.10 2.561077335e+01 1.12 2.391026426e+01 1.14 2.233663334e+01 1.16 2.087925647e+01 1.18 1.952851109e+01 1.20 1.827566970e+01 1.22 1.711280613e+01 1.24 1.603271277e+01 1.26 1.502882741e+01 1.28 1.409516840e+01 1.30 1.322627716e+01 1.32 1.241716696e+01 1.34 1.166327747e+01 1.36 1.096043404e+01 1.38 1.030481140e+01 1.40 9.692901196e+00 1.42 9.121482845e+00 1.44 8.587597372e+00 1.46 8.088523913e+00 1.48 7.621758556e+00 1.50 7.184995234e+00 1.52 6.775269227e+00 1.54 6.390015995e+00 1.56 6.027740476e+00 1.58 5.687039620e+00 1.60 5.366596782e+00 1.62 5.065176432e+00 1.64 4.781619171e+00 1.66 4.514837063e+00 1.68 4.263809233e+00 1.70 4.027577741e+00 1.72 3.805243707e+00 1.74 3.595963661e+00 1.76 3.398946132e+00 1.78 3.213448426e+00 1.80 3.038773618e+00 1.82 2.874267717e+00 1.84 2.719317008e+00 1.86 2.573345558e+00 1.88 2.435812877e+00 1.90 2.306211719e+00 1.92 2.184066021e+00 1.94 2.068928970e+00 1.96 1.960381184e+00 1.98 1.858029018e+00 2.00 1.761502959e+00 2.02 1.670456133e+00 2.04 1.584562897e+00 2.06 1.503517526e+00 2.08 1.427032973e+00 2.10 1.354839710e+00 2.12 1.286684646e+00 2.14 1.222330103e+00 2.16 1.161552864e+00 2.18 1.104143275e+00 2.20 1.049904406e+00 2.22 9.986512620e-01 2.24 9.502100477e-01 2.26 9.044174719e-01 2.28 8.611201000e-01 2.30 8.201737450e-01 2.32 7.814428971e-01 2.34 7.448001889e-01 2.36 7.101258933e-01 2.38 6.773074542e-01 2.40 6.462390448e-01 2.42 6.168211547e-01 2.44 5.889602025e-01 2.46 5.625681721e-01 2.48 5.375622722e-01 2.50 5.138646168e-01 2.52 4.914019257e-01 2.54 4.701052437e-01 2.56 4.499096769e-01 2.58 4.307541462e-01 2.60 4.011483145e-01 2.62 2.921700791e-01 2.64 1.834755029e-01 2.66 8.031510783e-02 2.68 -1.296556738e-02 2.70 -9.284252280e-02 2.72 -1.572803389e-01 2.74 -2.091638629e-01 2.76 -2.517718128e-01 2.78 -2.878136837e-01 2.80 -3.195743686e-01 2.82 -3.489554893e-01 2.84 -3.775140380e-01 2.86 -4.057080113e-01 2.88 -4.329258697e-01 2.90 -4.590445024e-01 2.92 -4.839723131e-01 2.94 -5.076447605e-01 2.96 -5.300210136e-01 2.98 -5.510808639e-01 3.00 -5.708218809e-01 3.02 -5.892567983e-01 3.04 -6.065289532e-01 3.06 -6.228270773e-01 3.08 -6.381956511e-01 3.10 -6.526759096e-01 3.12 -6.663064902e-01 3.14 -6.791236072e-01 3.16 -6.911612150e-01 3.18 -7.024511603e-01 3.20 -7.130233243e-01 3.22 -7.229057557e-01 3.24 -7.321247935e-01 3.26 -7.407051830e-01 3.28 -7.486701823e-01 3.30 -7.560416622e-01 3.32 -7.628401994e-01 3.34 -7.690851617e-01 3.36 -7.747947891e-01 3.38 -7.799862675e-01 3.40 -7.846757980e-01 3.42 -7.888786613e-01 3.44 -7.926093917e-01 3.46 -7.958816558e-01 3.48 -7.987081537e-01 3.50 -8.011009306e-01 3.52 -8.031221267e-01 3.54 -8.048299039e-01 3.56 -8.062296531e-01 3.58 -8.073264677e-01 3.60 -8.081251664e-01 3.62 -8.086302745e-01 3.64 -8.088457897e-01 3.66 -8.087755662e-01 3.68 -8.084232668e-01 3.70 -8.077923425e-01 3.72 -8.068860470e-01 3.74 -8.057069134e-01 3.76 -8.042561415e-01 3.78 -8.025346330e-01 3.80 -8.005431604e-01 3.82 -7.982823821e-01 3.84 -7.957528574e-01 3.86 -7.929550625e-01 3.88 -7.898894044e-01 3.90 -7.865562368e-01 3.92 -7.829558750e-01 3.94 -7.790886105e-01 3.96 -7.749547271e-01 3.98 -7.705545153e-01 4.00 -7.658882885e-01 4.02 -7.609563981e-01 4.04 -7.557592494e-01 4.06 -7.502973171e-01 4.08 -7.445711739e-01 4.10 -7.385841851e-01 4.12 -7.323458974e-01 4.14 -7.258274194e-01 4.16 -7.189793544e-01 4.18 -7.118233335e-01 4.20 -7.043839265e-01 4.22 -6.966874555e-01 4.24 -6.887618803e-01 4.26 -6.806366706e-01 4.28 -6.723426671e-01 4.30 -6.639119308e-01 4.32 -6.553775836e-01 4.34 -6.467736397e-01 4.36 -6.381348300e-01 4.38 -6.294964205e-01 4.40 -6.208940250e-01 4.42 -6.123634156e-01 4.44 -6.039403647e-01 4.46 -5.957959343e-01 4.48 -5.879774554e-01 4.50 -5.803495707e-01 4.52 -5.727788119e-01 4.54 -5.651350105e-01 4.56 -5.572919896e-01 4.58 -5.491192119e-01 4.60 -5.404854223e-01 4.62 -5.312677007e-01 4.64 -5.213528362e-01 4.66 -5.106384162e-01 4.68 -4.990338331e-01 4.70 -4.864611975e-01 4.72 -4.728561542e-01 4.74 -4.581685910e-01 4.76 -4.423632357e-01 4.78 -4.253301495e-01 4.80 -4.071255081e-01 4.82 -3.879763512e-01 4.84 -3.680975085e-01 4.86 -3.476907526e-01 4.88 -3.269441302e-01 4.90 -3.060314554e-01 4.92 -2.851119645e-01 4.94 -2.643302452e-01 4.96 -2.438253641e-01 4.98 -2.237378510e-01 5.00 -2.041955119e-01 5.02 -1.853122702e-01 5.04 -1.671887676e-01 5.06 -1.499131041e-01 5.08 -1.335617090e-01 5.10 -1.182003319e-01 5.12 -1.038851404e-01 5.14 -9.066391190e-02 5.16 -7.857488162e-02 5.18 -6.760889633e-02 5.20 -5.771853841e-02 5.22 -4.885423911e-02 5.24 -4.096632914e-02 5.26 -3.400030260e-02 5.28 -2.789278421e-02 5.30 -2.258081230e-02 5.32 -1.800307018e-02 5.34 -1.409993626e-02 5.36 -1.081344573e-02 5.38 -8.087187305e-03 5.40 -5.866155313e-03 5.42 -4.096574106e-03 5.44 -2.725709035e-03 5.46 -1.701675605e-03 5.48 -9.732561075e-04 5.50 -4.897309464e-04 5.52 -2.007300870e-04 5.54 -5.610850615e-05 5.56 -5.848240767e-06 5.58 0.000000000e+00 5.60 0.000000000e+00 5.62 0.000000000e+00 5.64 0.000000000e+00 5.66 0.000000000e+00 5.68 0.000000000e+00 5.70 0.000000000e+00 5.72 0.000000000e+00 5.74 0.000000000e+00 5.76 0.000000000e+00 5.78 0.000000000e+00 5.80 0.000000000e+00 5.82 0.000000000e+00 5.84 0.000000000e+00 5.86 0.000000000e+00 5.88 0.000000000e+00 5.90 0.000000000e+00 5.92 0.000000000e+00 5.94 0.000000000e+00 5.96 0.000000000e+00 5.98 0.000000000e+00 6.00 0.000000000e+00 6.02 0.000000000e+00 6.04 0.000000000e+00 6.06 0.000000000e+00 6.08 0.000000000e+00 6.10 0.000000000e+00 6.12 0.000000000e+00 6.14 0.000000000e+00 6.16 0.000000000e+00 6.18 0.000000000e+00 6.20 0.000000000e+00 6.22 0.000000000e+00 6.24 0.000000000e+00 6.26 0.000000000e+00 6.28 0.000000000e+00 6.30 0.000000000e+00 6.32 0.000000000e+00 6.34 0.000000000e+00 6.36 0.000000000e+00 6.38 0.000000000e+00 6.40 0.000000000e+00 6.42 0.000000000e+00 6.44 0.000000000e+00 6.46 0.000000000e+00 6.48 0.000000000e+00 6.50 0.000000000e+00 6.52 0.000000000e+00 6.54 0.000000000e+00 6.56 0.000000000e+00 6.58 0.000000000e+00 6.60 0.000000000e+00 6.62 0.000000000e+00 6.64 0.000000000e+00 6.66 0.000000000e+00 6.68 0.000000000e+00 6.70 0.000000000e+00 6.72 0.000000000e+00 6.74 0.000000000e+00 6.76 0.000000000e+00 6.78 0.000000000e+00 6.80 0.000000000e+00 6.82 0.000000000e+00 6.84 0.000000000e+00 6.86 0.000000000e+00 6.88 0.000000000e+00 6.90 0.000000000e+00 6.92 0.000000000e+00 6.94 0.000000000e+00 6.96 0.000000000e+00 6.98 0.000000000e+00 7.00 0.000000000e+00 7.02 0.000000000e+00 7.04 0.000000000e+00 7.06 0.000000000e+00 7.08 0.000000000e+00 7.10 0.000000000e+00 7.12 0.000000000e+00 7.14 0.000000000e+00 7.16 0.000000000e+00 7.18 0.000000000e+00 7.20 0.000000000e+00 7.22 0.000000000e+00 7.24 0.000000000e+00 7.26 0.000000000e+00 7.28 0.000000000e+00 7.30 0.000000000e+00 7.32 0.000000000e+00 7.34 0.000000000e+00 7.36 0.000000000e+00 7.38 0.000000000e+00 7.40 0.000000000e+00 7.42 0.000000000e+00 7.44 0.000000000e+00 7.46 0.000000000e+00 7.48 0.000000000e+00 7.50 0.000000000e+00 7.52 0.000000000e+00 7.54 0.000000000e+00 7.56 0.000000000e+00 7.58 0.000000000e+00 7.60 0.000000000e+00 7.62 0.000000000e+00 7.64 0.000000000e+00 7.66 0.000000000e+00 7.68 0.000000000e+00 7.70 0.000000000e+00 7.72 0.000000000e+00 7.74 0.000000000e+00 7.76 0.000000000e+00 7.78 0.000000000e+00 7.80 0.000000000e+00 7.82 0.000000000e+00 7.84 0.000000000e+00 7.86 0.000000000e+00 7.88 0.000000000e+00 7.90 0.000000000e+00 7.92 0.000000000e+00 7.94 0.000000000e+00 7.96 0.000000000e+00 7.98 0.000000000e+00 8.00 0.000000000e+00 8.02 0.000000000e+00 8.04 0.000000000e+00 8.06 0.000000000e+00 8.08 0.000000000e+00 8.10 0.000000000e+00 8.12 0.000000000e+00 8.14 0.000000000e+00 8.16 0.000000000e+00 8.18 0.000000000e+00 8.20 0.000000000e+00 8.22 0.000000000e+00 8.24 0.000000000e+00 8.26 0.000000000e+00 8.28 0.000000000e+00 8.30 0.000000000e+00 8.32 0.000000000e+00 8.34 0.000000000e+00 8.36 0.000000000e+00 8.38 0.000000000e+00 8.40 0.000000000e+00 8.42 0.000000000e+00 8.44 0.000000000e+00 8.46 0.000000000e+00 8.48 0.000000000e+00 8.50 0.000000000e+00 8.52 0.000000000e+00 8.54 0.000000000e+00 8.56 0.000000000e+00 8.58 0.000000000e+00 8.60 0.000000000e+00 8.62 0.000000000e+00 8.64 0.000000000e+00 8.66 0.000000000e+00 8.68 0.000000000e+00 8.70 0.000000000e+00 8.72 0.000000000e+00 8.74 0.000000000e+00 8.76 0.000000000e+00 8.78 0.000000000e+00 8.80 0.000000000e+00 8.82 0.000000000e+00 8.84 0.000000000e+00 8.86 0.000000000e+00 8.88 0.000000000e+00 8.90 0.000000000e+00 8.92 0.000000000e+00 8.94 0.000000000e+00 8.96 0.000000000e+00 8.98 0.000000000e+00 9.00 0.000000000e+00 9.02 0.000000000e+00 9.04 0.000000000e+00 9.06 0.000000000e+00 9.08 0.000000000e+00 9.10 0.000000000e+00 9.12 0.000000000e+00 9.14 0.000000000e+00 9.16 0.000000000e+00 9.18 0.000000000e+00 9.20 0.000000000e+00 9.22 0.000000000e+00 9.24 0.000000000e+00 9.26 0.000000000e+00 9.28 0.000000000e+00 9.30 0.000000000e+00 9.32 0.000000000e+00 9.34 0.000000000e+00 9.36 0.000000000e+00 9.38 0.000000000e+00 9.40 0.000000000e+00 9.42 0.000000000e+00 9.44 0.000000000e+00 9.46 0.000000000e+00 9.48 0.000000000e+00 9.50 0.000000000e+00 9.52 0.000000000e+00 9.54 0.000000000e+00 9.56 0.000000000e+00 9.58 0.000000000e+00 9.60 0.000000000e+00 9.62 0.000000000e+00 9.64 0.000000000e+00 9.66 0.000000000e+00 9.68 0.000000000e+00 9.70 0.000000000e+00 9.72 0.000000000e+00 9.74 0.000000000e+00 9.76 0.000000000e+00 9.78 0.000000000e+00 9.80 0.000000000e+00 9.82 0.000000000e+00 9.84 0.000000000e+00 9.86 0.000000000e+00 9.88 0.000000000e+00 9.90 0.000000000e+00 9.92 0.000000000e+00 9.94 0.000000000e+00 9.96 0.000000000e+00 9.98 0.000000000e+00 10.00 0.000000000e+00