# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2003--Nord-J-Albe-K-Erhart-P-Nordlund-K--Ga-N # implementation = 2003--Nord-J--Ga-N--LAMMPS--ipr1 # composition = GaN3 # 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 nan nan nan 0.66 3.683617455e+03 nan nan 0.68 3.305670422e+03 nan nan 0.70 2.973905326e+03 nan nan 0.72 2.679738147e+03 3.677994170e+03 nan 0.74 2.417667549e+03 3.334984511e+03 3.678465052e+03 0.76 2.185749303e+03 3.031055054e+03 3.347633064e+03 0.78 1.976187003e+03 2.756452821e+03 3.044441142e+03 0.80 1.790635762e+03 2.509703467e+03 2.768285228e+03 0.82 1.623275439e+03 2.284626024e+03 2.517779923e+03 0.84 1.469888122e+03 2.077327340e+03 2.291117891e+03 0.86 1.333168399e+03 1.886454030e+03 2.093448772e+03 0.88 1.211076662e+03 1.715592353e+03 1.919427625e+03 0.90 1.103350462e+03 1.569547033e+03 1.761686455e+03 0.92 1.009131553e+03 1.442977942e+03 1.618377249e+03 0.94 9.253243027e+02 1.326671818e+03 1.486892230e+03 0.96 8.480743649e+02 1.219232120e+03 1.366431021e+03 0.98 7.772174750e+02 1.119595905e+03 1.255718672e+03 1.00 7.127482234e+02 1.027945325e+03 1.155050735e+03 1.02 6.536780926e+02 9.461288474e+02 1.065114241e+03 1.04 5.975166652e+02 8.748451686e+02 9.835287079e+02 1.06 5.444202656e+02 8.102736616e+02 9.055763802e+02 1.08 4.950487268e+02 7.488950578e+02 8.314688076e+02 1.10 4.489591403e+02 6.885021134e+02 7.613468157e+02 1.12 4.071371437e+02 6.295062233e+02 6.962726985e+02 1.14 3.706939998e+02 5.729497795e+02 6.375793189e+02 1.16 3.397274299e+02 5.200676522e+02 5.869924883e+02 1.18 3.113371701e+02 4.724391501e+02 5.444972264e+02 1.20 2.839895857e+02 4.316472479e+02 5.059913609e+02 1.22 2.572676862e+02 3.974601027e+02 4.698746188e+02 1.24 2.316750097e+02 3.683829432e+02 4.345274398e+02 1.26 2.080369769e+02 3.422150179e+02 3.999572365e+02 1.28 1.871504195e+02 3.177976074e+02 3.665392145e+02 1.30 1.689964537e+02 2.948977799e+02 3.347751417e+02 1.32 1.530804269e+02 2.734321698e+02 3.052580829e+02 1.34 1.398132555e+02 2.532141759e+02 2.786721132e+02 1.36 1.292040834e+02 2.341624834e+02 2.556923780e+02 1.38 1.196649448e+02 2.160123500e+02 2.365511488e+02 1.40 1.106903986e+02 1.988692629e+02 2.204270613e+02 1.42 1.022959412e+02 1.828010321e+02 2.053080917e+02 1.44 9.449998218e+01 1.672820120e+02 1.910074428e+02 1.46 8.731180090e+01 1.525113543e+02 1.775703362e+02 1.48 8.072423838e+01 1.386248607e+02 1.650548251e+02 1.50 7.470873552e+01 1.252806965e+02 1.534683055e+02 1.52 6.896870344e+01 1.126326595e+02 1.427461332e+02 1.54 6.330684777e+01 1.009803720e+02 1.326746918e+02 1.56 5.777830980e+01 9.063816544e+01 1.232108966e+02 1.58 5.243419952e+01 8.163734292e+01 1.139345080e+02 1.60 4.726024430e+01 7.422038447e+01 1.046300521e+02 1.62 4.235863250e+01 6.853473574e+01 9.545803384e+01 1.64 3.784327943e+01 6.380070940e+01 8.656657650e+01 1.66 3.374503786e+01 5.938540652e+01 7.808961394e+01 1.68 3.012804606e+01 5.522459154e+01 7.014901026e+01 1.70 2.703053403e+01 5.120576424e+01 6.285921246e+01 1.72 2.443710863e+01 4.736183927e+01 5.622515030e+01 1.74 2.214471310e+01 4.373356384e+01 5.034384919e+01 1.76 1.997697288e+01 4.031956732e+01 4.539249956e+01 1.78 1.790503039e+01 3.713986344e+01 4.149734916e+01 1.80 1.592152002e+01 3.420426485e+01 3.856064265e+01 1.82 1.402068807e+01 3.150401903e+01 3.591206480e+01 1.84 1.220056027e+01 2.901908622e+01 3.343794150e+01 1.86 1.046721328e+01 2.671948063e+01 3.112707657e+01 1.88 8.840854978e+00 2.455311599e+01 2.896898034e+01 1.90 7.362353303e+00 2.250929124e+01 2.695382562e+01 1.92 6.094998763e+00 2.058450212e+01 2.507240628e+01 1.94 5.111547805e+00 1.877712693e+01 2.330133310e+01 1.96 4.460207693e+00 1.708807472e+01 2.161204289e+01 1.98 3.991921469e+00 1.552127129e+01 2.000955464e+01 2.00 3.563684650e+00 1.408364086e+01 1.850054586e+01 2.02 3.158645565e+00 1.276196070e+01 1.706473570e+01 2.04 2.763592164e+00 1.154349965e+01 1.568582068e+01 2.06 2.380166967e+00 1.043697191e+01 1.437222273e+01 2.08 2.009280138e+00 9.448290685e+00 1.312737331e+01 2.10 1.651237607e+00 8.529426422e+00 1.195032024e+01 2.12 1.305857531e+00 7.642037350e+00 1.083668511e+01 2.14 9.725854352e-01 6.783861030e+00 9.779310086e+00 2.16 6.506207472e-01 5.951653942e+00 8.761481840e+00 2.18 3.390712389e-01 5.141239429e+00 7.772797882e+00 2.20 3.715723462e-02 4.347598638e+00 6.805627951e+00 2.22 -2.555065389e-01 3.565071533e+00 5.850421153e+00 2.24 -5.385200832e-01 2.787797715e+00 4.895595688e+00 2.26 -8.101742450e-01 2.010642274e+00 3.927734856e+00 2.28 -1.066805637e+00 1.231045416e+00 2.932695975e+00 2.30 -1.302135137e+00 4.524970579e-01 1.899082525e+00 2.32 -1.506872511e+00 -3.095197224e-01 8.271932889e-01 2.34 -1.669107213e+00 -1.019049335e+00 -2.513878594e-01 2.36 -1.776122460e+00 -1.615418096e+00 -1.241356516e+00 2.38 -1.817882799e+00 -2.008869543e+00 -1.962072027e+00 2.40 -1.791285129e+00 -2.124829953e+00 -2.212312908e+00 2.42 -1.731621581e+00 -2.093345057e+00 -2.188515284e+00 2.44 -1.661180554e+00 -2.058125378e+00 -2.160813219e+00 2.46 -1.576329927e+00 -2.018977230e+00 -2.129699810e+00 2.48 -1.478084908e+00 -1.975973216e+00 -2.095626135e+00 2.50 -1.367663044e+00 -1.929433512e+00 -2.059004362e+00 2.52 -1.246604210e+00 -1.879883395e+00 -2.020210647e+00 2.54 -1.116860690e+00 -1.827993366e+00 -1.979587831e+00 2.56 -9.808491894e-01 -1.774510369e+00 -1.937447947e+00 2.58 -8.414586476e-01 -1.720189583e+00 -1.894074556e+00 2.60 -7.020090277e-01 -1.665735589e+00 -1.849724924e+00 2.62 -5.661572801e-01 -1.611759439e+00 -1.804632036e+00 2.64 -4.377481060e-01 -1.558754532e+00 -1.759006477e+00 2.66 -3.206102226e-01 -1.507090160e+00 -1.713038179e+00 2.68 -2.183049482e-01 -1.457018310e+00 -1.666898040e+00 2.70 -1.338440012e-01 -1.408449041e+00 -1.620739435e+00 2.72 -6.940672580e-02 -1.354343274e+00 -1.569733521e+00 2.74 -2.609997503e-02 -1.288980085e+00 -1.509052286e+00 2.76 -3.810169971e-03 -1.213682815e+00 -1.438803378e+00 2.78 0.000000000e+00 -1.129869314e+00 -1.359149409e+00 2.80 0.000000000e+00 -1.039062582e+00 -1.270426570e+00 2.82 0.000000000e+00 -9.428963123e-01 -1.173246534e+00 2.84 0.000000000e+00 -8.431124765e-01 -1.068574764e+00 2.86 0.000000000e+00 -7.415488061e-01 -9.577800309e-01 2.88 0.000000000e+00 -6.401148239e-01 -8.426513690e-01 2.90 0.000000000e+00 -5.407558584e-01 -7.253799468e-01 2.92 0.000000000e+00 -4.454053532e-01 -6.085044502e-01 2.94 0.000000000e+00 -3.559267669e-01 -4.948198088e-01 2.96 0.000000000e+00 -2.740474847e-01 -3.872507729e-01 2.98 0.000000000e+00 -2.012884167e-01 -2.886943955e-01 3.00 0.000000000e+00 -1.388942201e-01 -2.018392345e-01 3.02 0.000000000e+00 -8.777016827e-02 -1.289741118e-01 3.04 0.000000000e+00 -4.843228985e-02 -7.180487138e-02 3.06 0.000000000e+00 -2.097718969e-02 -3.130222455e-02 3.08 0.000000000e+00 -5.076686103e-03 -7.605129142e-03 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 0.000000000e+00 3.76 0.000000000e+00 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