# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu # implementation = 2004--Zhou-X-W--Cu--LAMMPS--ipr1 # 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 Cu Cu 0.02 6.397361890e+03 0.04 3.196591321e+03 0.06 2.129667798e+03 0.08 1.596206037e+03 0.10 1.276128980e+03 0.12 1.062744275e+03 0.14 9.103266290e+02 0.16 7.960133944e+02 0.18 7.071031008e+02 0.20 6.359748660e+02 0.22 5.777790374e+02 0.24 5.292825137e+02 0.26 4.882469936e+02 0.28 4.530736906e+02 0.30 4.225901614e+02 0.32 3.959170733e+02 0.34 3.723819956e+02 0.36 3.514619265e+02 0.38 3.327439700e+02 0.40 3.158978091e+02 0.42 3.006560445e+02 0.44 2.867998948e+02 0.46 2.741486278e+02 0.48 2.625516329e+02 0.50 2.518181492e+02 0.52 2.355834946e+02 0.54 2.203055486e+02 0.56 2.059848846e+02 0.58 1.925622764e+02 0.60 1.799819099e+02 0.62 1.681911933e+02 0.64 1.571412278e+02 0.66 1.467859404e+02 0.68 1.370819121e+02 0.70 1.279887496e+02 0.72 1.194684081e+02 0.74 1.114851278e+02 0.76 1.040054957e+02 0.78 9.699813277e+01 0.80 9.043352483e+01 0.82 8.428412540e+01 0.84 7.852405278e+01 0.86 7.312889289e+01 0.88 6.807598901e+01 0.90 6.334385001e+01 0.92 5.891250796e+01 0.94 5.476300086e+01 0.96 5.087626803e+01 0.98 4.723654530e+01 1.00 4.382956128e+01 1.02 4.064168979e+01 1.04 3.766016135e+01 1.06 3.487277234e+01 1.08 3.226795268e+01 1.10 2.983482082e+01 1.12 2.756302676e+01 1.14 2.544273467e+01 1.16 2.346453391e+01 1.18 2.161958742e+01 1.20 1.989953771e+01 1.22 1.829655960e+01 1.24 1.680324069e+01 1.26 1.541267346e+01 1.28 1.411832377e+01 1.30 1.291404222e+01 1.32 1.179408120e+01 1.34 1.075301670e+01 1.36 9.785762587e+00 1.38 8.887547358e+00 1.40 8.053875009e+00 1.42 7.280547335e+00 1.44 6.563604209e+00 1.46 5.899343264e+00 1.48 5.284283639e+00 1.50 4.715170651e+00 1.52 4.188944211e+00 1.54 3.702735720e+00 1.56 3.253863713e+00 1.58 2.839807112e+00 1.60 2.458208978e+00 1.62 2.106860382e+00 1.64 1.783696833e+00 1.66 1.486777480e+00 1.68 1.214292323e+00 1.70 9.645460844e-01 1.72 7.359494250e-01 1.74 5.270182164e-01 1.76 3.363670541e-01 1.78 1.626948335e-01 1.80 4.789015225e-03 1.82 -1.384836954e-01 1.84 -2.681832014e-01 1.86 -3.852990648e-01 1.88 -4.907558946e-01 1.90 -5.854164247e-01 1.92 -6.700849681e-01 1.94 -7.455148070e-01 1.96 -8.124058370e-01 1.98 -8.714129479e-01 2.00 -9.231450722e-01 2.02 -9.681706979e-01 2.04 -1.007019240e+00 2.06 -1.040183630e+00 2.08 -1.068124203e+00 2.10 -1.091266075e+00 2.12 -1.110009260e+00 2.14 -1.124722922e+00 2.16 -1.135750911e+00 2.18 -1.143412018e+00 2.20 -1.148005211e+00 2.22 -1.149804704e+00 2.24 -1.149067276e+00 2.26 -1.146030332e+00 2.28 -1.140913596e+00 2.30 -1.133921471e+00 2.32 -1.125242642e+00 2.34 -1.115052437e+00 2.36 -1.103512417e+00 2.38 -1.090772758e+00 2.40 -1.076971296e+00 2.42 -1.062235897e+00 2.44 -1.046684145e+00 2.46 -1.030425263e+00 2.48 -1.013558455e+00 2.50 -9.961768934e-01 2.52 -9.783644444e-01 2.54 -9.601994302e-01 2.56 -9.417528428e-01 2.58 -9.230907159e-01 2.60 -9.042733953e-01 2.62 -8.853550117e-01 2.64 -8.663867421e-01 2.66 -8.474136139e-01 2.68 -8.284782550e-01 2.70 -8.096182875e-01 2.72 -7.908688270e-01 2.74 -7.722612935e-01 2.76 -7.538240582e-01 2.78 -7.355835576e-01 2.80 -7.175635044e-01 2.82 -6.997842394e-01 2.84 -6.822657018e-01 2.86 -6.650241854e-01 2.88 -6.480758613e-01 2.90 -6.314329769e-01 2.92 -6.151085650e-01 2.94 -5.991127807e-01 2.96 -5.834541274e-01 2.98 -5.681396620e-01 3.00 -5.531749660e-01 3.02 -5.385638137e-01 3.04 -5.243089360e-01 3.06 -5.104097368e-01 3.08 -4.968652317e-01 3.10 -4.836706274e-01 3.12 -4.708202498e-01 3.14 -4.583049532e-01 3.16 -4.461141256e-01 3.18 -4.342344518e-01 3.20 -4.226509262e-01 3.22 -4.113464072e-01 3.24 -4.003028770e-01 3.26 -3.895017440e-01 3.28 -3.789256296e-01 3.30 -3.685568339e-01 3.32 -3.583809891e-01 3.34 -3.483848566e-01 3.36 -3.385596080e-01 3.38 -3.288981370e-01 3.40 -3.193976292e-01 3.42 -3.100573814e-01 3.44 -3.008795389e-01 3.46 -2.918677271e-01 3.48 -2.830270796e-01 3.50 -2.743630381e-01 3.52 -2.658817857e-01 3.54 -2.575882112e-01 3.56 -2.494875832e-01 3.58 -2.415832378e-01 3.60 -2.338785541e-01 3.62 -2.263747752e-01 3.64 -2.190728654e-01 3.66 -2.119723133e-01 3.68 -2.050718703e-01 3.70 -1.983692218e-01 3.72 -1.918614763e-01 3.74 -1.855448067e-01 3.76 -1.794152809e-01 3.78 -1.734677101e-01 3.80 -1.676972110e-01 3.82 -1.620979008e-01 3.84 -1.566639801e-01 3.86 -1.513890555e-01 3.88 -1.462664875e-01 3.90 -1.412894321e-01 3.92 -1.364506752e-01 3.94 -1.317426727e-01 3.96 -1.271576611e-01 3.98 -1.226875239e-01 4.00 -1.183240505e-01 4.02 -1.140582870e-01 4.04 -1.098813891e-01 4.06 -1.057841920e-01 4.08 -1.017570535e-01 4.10 -9.779032993e-02 4.12 -9.387446282e-02 4.14 -8.999976898e-02 4.16 -8.615707782e-02 4.18 -8.233746234e-02 4.20 -7.853304698e-02 4.22 -7.473712961e-02 4.24 -7.094471598e-02 4.26 -6.715289844e-02 4.28 -6.336120974e-02 4.30 -5.957236835e-02 4.32 -5.579256563e-02 4.34 -5.203141000e-02 4.36 -4.830246461e-02 4.38 -4.462241086e-02 4.40 -4.101067020e-02 4.42 -3.748896559e-02 4.44 -3.408048298e-02 4.46 -3.080821727e-02 4.48 -2.769356615e-02 4.50 -2.475538152e-02 4.52 -2.200897450e-02 4.54 -1.946511323e-02 4.56 -1.712982649e-02 4.58 -1.500454035e-02 4.60 -1.308633360e-02 4.62 -1.136835991e-02 4.64 -9.840790973e-03 4.66 -8.491413546e-03 4.68 -7.306536117e-03 4.70 -6.271676345e-03 4.72 -5.372115187e-03 4.74 -4.593437293e-03 4.76 -3.921817377e-03 4.78 -3.344353501e-03 4.80 -2.849185315e-03 4.82 -2.425521857e-03 4.84 -2.063731379e-03 4.86 -1.755244292e-03 4.88 -1.492534930e-03 4.90 -1.269032046e-03 4.92 -1.079023545e-03 4.94 -9.175824010e-04 4.96 -7.804581640e-04 4.98 -6.640150702e-04 5.00 -5.651444255e-04 5.02 -4.811886006e-04 5.04 -4.098907416e-04 5.06 -3.493272603e-04 5.08 -2.978682908e-04 5.10 -2.541287438e-04 5.12 -2.169368205e-04 5.14 -1.852964949e-04 5.16 -1.583674329e-04 5.18 -1.354356637e-04 5.20 -1.158966149e-04 5.22 -9.923978639e-05 5.24 -8.503119861e-05 5.26 -7.290384514e-05 5.28 -6.254631482e-05 5.30 -5.369498147e-05 5.32 -4.612632600e-05 5.34 -3.964993915e-05 5.36 -3.410470265e-05 5.38 -2.935388099e-05 5.40 -2.528099014e-05 5.42 -2.178702982e-05 5.44 -1.878778899e-05 5.46 -1.621152849e-05 5.48 -1.399733571e-05 5.50 -1.209296446e-05 5.52 -1.045409379e-05 5.54 -9.042786167e-06 5.56 -7.826737550e-06 5.58 -6.778286288e-06 5.60 -5.873737732e-06 5.62 -5.092864795e-06 5.64 -4.418384581e-06 5.66 -3.835441834e-06 5.68 -3.331292818e-06 5.70 -2.895052252e-06 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