# Diatom energy (eV) vs. radial distance (Angstrom). # potential = 2004--Mishin-Y--Ni-Al # implementation = EAM_Dynamo_Mishin_2004_NiAl__MO_101214310689_005 # 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 Al Al Al Ni Ni Ni 0.02 3.429784079e+01 3.404614220e+02 -4.831973040e-01 0.04 3.338884698e+01 3.298061193e+02 -2.507461797e-01 0.06 3.249670188e+01 3.193812475e+02 -2.793622613e-02 0.08 3.162123609e+01 3.091842176e+02 1.853760852e-01 0.10 3.076228020e+01 2.992124408e+02 3.893343564e-01 0.12 2.991966480e+01 2.894633281e+02 5.840822615e-01 0.14 2.909322048e+01 2.799342904e+02 7.697635446e-01 0.16 2.828277785e+01 2.706227387e+02 9.465220182e-01 0.18 2.748816750e+01 2.615260840e+02 1.114501560e+00 0.20 2.670922003e+01 2.526417372e+02 1.273846112e+00 0.22 2.594576603e+01 2.439671091e+02 1.424699679e+00 0.24 2.519763611e+01 2.354996107e+02 1.567206323e+00 0.26 2.446466086e+01 2.272366528e+02 1.701510167e+00 0.28 2.374667088e+01 2.191756462e+02 1.827755389e+00 0.30 2.304349678e+01 2.113140017e+02 1.946086219e+00 0.32 2.235496915e+01 2.036491301e+02 2.056646945e+00 0.34 2.168091859e+01 1.961784422e+02 2.159581902e+00 0.36 2.102117571e+01 1.888993486e+02 2.255035479e+00 0.38 2.037557111e+01 1.818092602e+02 2.343152112e+00 0.40 1.974393539e+01 1.749055875e+02 2.424076283e+00 0.42 1.912609916e+01 1.681857414e+02 2.497952521e+00 0.44 1.852189303e+01 1.616471324e+02 2.564925399e+00 0.46 1.793114759e+01 1.552871713e+02 2.625139533e+00 0.48 1.735369345e+01 1.491032686e+02 2.678739583e+00 0.50 1.678936123e+01 1.430928350e+02 2.725870251e+00 0.52 1.623798153e+01 1.372532811e+02 2.766676279e+00 0.54 1.569938495e+01 1.315820175e+02 2.801302449e+00 0.56 1.517340212e+01 1.260764548e+02 2.829893581e+00 0.58 1.465986363e+01 1.207340034e+02 2.852594532e+00 0.60 1.415860011e+01 1.155520741e+02 2.869550201e+00 0.62 1.366944216e+01 1.105280773e+02 2.880905520e+00 0.64 1.319222039e+01 1.056594235e+02 2.886805460e+00 0.66 1.272676542e+01 1.009435233e+02 2.887395026e+00 0.68 1.227290787e+01 9.637778719e+01 2.882819260e+00 0.70 1.183047835e+01 9.195962561e+01 2.873223238e+00 0.72 1.139930748e+01 8.768644908e+01 2.858752073e+00 0.74 1.097922588e+01 8.355566807e+01 2.839550911e+00 0.76 1.057006416e+01 7.956469303e+01 2.815764935e+00 0.78 1.017165296e+01 7.571093441e+01 2.787539361e+00 0.80 9.783822877e+00 7.199180265e+01 2.755019440e+00 0.82 9.406404549e+00 6.840470819e+01 2.718350457e+00 0.84 9.039228598e+00 6.494706145e+01 2.677677734e+00 0.86 8.682125648e+00 6.161627283e+01 2.633146627e+00 0.88 8.334926327e+00 5.840975274e+01 2.584902525e+00 0.90 7.997461262e+00 5.532491158e+01 2.533090855e+00 0.92 7.669561084e+00 5.235915972e+01 2.477857079e+00 0.94 7.351056423e+00 4.950990755e+01 2.419346695e+00 0.96 7.041777912e+00 4.677456543e+01 2.357705239e+00 0.98 6.741556185e+00 4.415054373e+01 2.293078284e+00 1.00 6.450221878e+00 4.163525279e+01 2.225611439e+00 1.02 6.167605627e+00 3.922610297e+01 2.155450353e+00 1.04 5.893538073e+00 3.692050461e+01 2.082740714e+00 1.06 5.627849855e+00 3.471586803e+01 2.007628246e+00 1.08 5.370371617e+00 3.260960356e+01 1.930258719e+00 1.10 5.120934003e+00 3.059912153e+01 1.850777942e+00 1.12 4.879367659e+00 2.868183225e+01 1.769331766e+00 1.14 4.645503233e+00 2.685514603e+01 1.686066085e+00 1.16 4.419171376e+00 2.511647317e+01 1.601126838e+00 1.18 4.200202740e+00 2.346322399e+01 1.514660008e+00 1.20 3.988427980e+00 2.189280877e+01 1.426811624e+00 1.22 3.783677751e+00 2.040263782e+01 1.337727765e+00 1.24 3.585782714e+00 1.899012144e+01 1.247554554e+00 1.26 3.394573529e+00 1.765266991e+01 1.156438167e+00 1.28 3.209880861e+00 1.638769354e+01 1.064524830e+00 1.30 3.031535376e+00 1.519260262e+01 9.719608213e-01 1.32 2.859367742e+00 1.406480745e+01 8.788924733e-01 1.34 2.693208631e+00 1.300171834e+01 7.854661737e-01 1.36 2.532888718e+00 1.200074559e+01 6.918283665e-01 1.38 2.378238680e+00 1.105929952e+01 5.981255541e-01 1.40 2.229089197e+00 1.017479047e+01 5.045042998e-01 1.42 2.085270954e+00 9.344628753e+00 4.111112301e-01 1.44 1.946614636e+00 8.566224735e+00 3.180930350e-01 1.46 1.812950933e+00 7.836988777e+00 2.255964698e-01 1.48 1.684110539e+00 7.154331259e+00 1.337683595e-01 1.50 1.559924149e+00 6.515662587e+00 4.275560101e-02 1.52 1.440222879e+00 5.918395117e+00 -4.729437566e-02 1.54 1.324842929e+00 5.359994566e+00 -1.362326437e-01 1.56 1.213627860e+00 4.838066483e+00 -2.239145752e-01 1.58 1.106427587e+00 4.350363503e+00 -3.102019853e-01 1.60 1.003098002e+00 3.894776352e+00 -3.949632095e-01 1.62 9.035006290e-01 3.469325373e+00 -4.780732021e-01 1.64 8.075023047e-01 3.072152584e+00 -5.594135952e-01 1.66 7.149749104e-01 2.701514205e+00 -6.388727611e-01 1.68 6.257951148e-01 2.355773644e+00 -7.163458695e-01 1.70 5.398441551e-01 2.033394910e+00 -7.917349359e-01 1.72 4.570076481e-01 1.732936423e+00 -8.649488438e-01 1.74 3.771754077e-01 1.453045207e+00 -9.359033728e-01 1.76 3.002413171e-01 1.192451432e+00 -1.004521230e+00 1.78 2.261031915e-01 9.499632904e-01 -1.070732050e+00 1.80 1.546626775e-01 7.244621822e-01 -1.134472382e+00 1.82 8.582516803e-02 5.148981973e-01 -1.195685682e+00 1.84 1.949972406e-02 3.202858824e-01 -1.254322272e+00 1.86 -4.440098755e-02 1.397002436e-01 -1.310339292e+00 1.88 -1.059607389e-01 -2.772698405e-02 -1.363700637e+00 1.90 -1.652597937e-01 -1.828108489e-01 -1.414376896e+00 1.92 -2.223749378e-01 -3.263164835e-01 -1.462345260e+00 1.94 -2.773795255e-01 -4.589621914e-01 -1.507589419e+00 1.96 -3.303435103e-01 -5.814223513e-01 -1.550099458e+00 1.98 -3.813334847e-01 -6.943301475e-01 -1.589871726e+00 2.00 -4.304127239e-01 -7.982801006e-01 -1.626908705e+00 2.02 -4.776412324e-01 -8.938304801e-01 -1.661218860e+00 2.04 -5.230758009e-01 -9.815055353e-01 -1.692816472e+00 2.06 -5.667700691e-01 -1.061797616e+00 -1.721721468e+00 2.08 -6.087745984e-01 -1.135169150e+00 -1.747959236e+00 2.10 -6.491369542e-01 -1.202054488e+00 -1.771560429e+00 2.12 -6.879018025e-01 -1.262861660e+00 -1.792560755e+00 2.14 -7.251110141e-01 -1.317973998e+00 -1.811000768e+00 2.16 -7.608037807e-01 -1.367751664e+00 -1.826925638e+00 2.18 -7.950167423e-01 -1.412533093e+00 -1.840384913e+00 2.20 -8.277841272e-01 -1.452636325e+00 -1.851432283e+00 2.22 -8.591379003e-01 -1.488360281e+00 -1.860125327e+00 2.24 -8.891079195e-01 -1.519985933e+00 -1.866525255e+00 2.26 -9.177220998e-01 -1.547777407e+00 -1.870696649e+00 2.28 -9.450065846e-01 -1.571983040e+00 -1.872707194e+00 2.30 -9.709859224e-01 -1.592836326e+00 -1.872627408e+00 2.32 -9.956832449e-01 -1.610556848e+00 -1.870530368e+00 2.34 -1.019120446e+00 -1.625351122e+00 -1.866491429e+00 2.36 -1.041318369e+00 -1.637413392e+00 -1.860587955e+00 2.38 -1.062296986e+00 -1.646926387e+00 -1.852899030e+00 2.40 -1.082075577e+00 -1.654062021e+00 -1.843505189e+00 2.42 -1.100672903e+00 -1.658982038e+00 -1.832488137e+00 2.44 -1.118107378e+00 -1.661838650e+00 -1.819930475e+00 2.46 -1.134397227e+00 -1.662775091e+00 -1.805915431e+00 2.48 -1.149560630e+00 -1.661926162e+00 -1.790526593e+00 2.50 -1.163615876e+00 -1.659418755e+00 -1.773847647e+00 2.52 -1.176581487e+00 -1.655372301e+00 -1.755962122e+00 2.54 -1.188476340e+00 -1.649899219e+00 -1.736953144e+00 2.56 -1.199319776e+00 -1.643105356e+00 -1.716903192e+00 2.58 -1.209131696e+00 -1.635090338e+00 -1.695893867e+00 2.60 -1.217932639e+00 -1.625947964e+00 -1.674005671e+00 2.62 -1.225743843e+00 -1.615766543e+00 -1.651317792e+00 2.64 -1.232587307e+00 -1.604629193e+00 -1.627907902e+00 2.66 -1.238485813e+00 -1.592614176e+00 -1.603851967e+00 2.68 -1.243462962e+00 -1.579795154e+00 -1.579224068e+00 2.70 -1.247543187e+00 -1.566241449e+00 -1.554096232e+00 2.72 -1.250751747e+00 -1.552018326e+00 -1.528538283e+00 2.74 -1.253114714e+00 -1.537187171e+00 -1.502617695e+00 2.76 -1.254658945e+00 -1.521805760e+00 -1.476399467e+00 2.78 -1.255412031e+00 -1.505928434e+00 -1.449946006e+00 2.80 -1.255402257e+00 -1.489606284e+00 -1.423317032e+00 2.82 -1.254658546e+00 -1.472887374e+00 -1.396569490e+00 2.84 -1.253210392e+00 -1.455816832e+00 -1.369757474e+00 2.86 -1.251087789e+00 -1.438437109e+00 -1.342932170e+00 2.88 -1.248321147e+00 -1.420788025e+00 -1.316141811e+00 2.90 -1.244941188e+00 -1.402906984e+00 -1.289431646e+00 2.92 -1.240978870e+00 -1.384829078e+00 -1.262843922e+00 2.94 -1.236465284e+00 -1.366587178e+00 -1.236417885e+00 2.96 -1.231431570e+00 -1.348212135e+00 -1.210189771e+00 2.98 -1.225908816e+00 -1.329732761e+00 -1.184192833e+00 3.00 -1.219927948e+00 -1.311176097e+00 -1.158457391e+00 3.02 -1.213519633e+00 -1.292567296e+00 -1.133010858e+00 3.04 -1.206714163e+00 -1.273929969e+00 -1.107877773e+00 3.06 -1.199541387e+00 -1.255285988e+00 -1.083079905e+00 3.08 -1.192030613e+00 -1.236655867e+00 -1.058636320e+00 3.10 -1.184210517e+00 -1.218058512e+00 -1.034563419e+00 3.12 -1.176109054e+00 -1.199511637e+00 -1.010875076e+00 3.14 -1.167753345e+00 -1.181031486e+00 -9.875827422e-01 3.16 -1.159169636e+00 -1.162633209e+00 -9.646954751e-01 3.18 -1.150383226e+00 -1.144330683e+00 -9.422201480e-01 3.20 -1.141418410e+00 -1.126136678e+00 -9.201615179e-01 3.22 -1.132298401e+00 -1.108062999e+00 -8.985222832e-01 3.24 -1.123045262e+00 -1.090120197e+00 -8.773033797e-01 3.26 -1.113679874e+00 -1.072318199e+00 -8.565038564e-01 3.28 -1.104221914e+00 -1.054665641e+00 -8.361212725e-01 3.30 -1.094689832e+00 -1.037170538e+00 -8.161516203e-01 3.32 -1.085100798e+00 -1.019840065e+00 -7.965895691e-01 3.34 -1.075470674e+00 -1.002680296e+00 -7.774285376e-01 3.36 -1.065813998e+00 -9.856970564e-01 -7.586608301e-01 3.38 -1.056144031e+00 -9.688950274e-01 -7.402778798e-01 3.40 -1.046472741e+00 -9.522781830e-01 -7.222701242e-01 3.42 -1.036810803e+00 -9.358503755e-01 -7.046273720e-01 3.44 -1.027167551e+00 -9.196142725e-01 -6.873389290e-01 3.46 -1.017551075e+00 -9.035720339e-01 -6.703932860e-01 3.48 -1.007968243e+00 -8.877258166e-01 -6.537791289e-01 3.50 -9.984247521e-01 -8.720767206e-01 -6.374841870e-01 3.52 -9.889250761e-01 -8.566249536e-01 -6.214967773e-01 3.54 -9.794725460e-01 -8.413710532e-01 -6.058045621e-01 3.56 -9.700694102e-01 -8.263152948e-01 -5.903952789e-01 3.58 -9.607169348e-01 -8.114567151e-01 -5.752576754e-01 3.60 -9.514153874e-01 -7.967945284e-01 -5.603791734e-01 3.62 -9.421640733e-01 -7.823285119e-01 -5.457494886e-01 3.64 -9.329613953e-01 -7.680567909e-01 -5.313570812e-01 3.66 -9.238050077e-01 -7.539763246e-01 -5.171904429e-01 3.68 -9.146918537e-01 -7.400839547e-01 -5.032395305e-01 3.70 -9.056181575e-01 -7.263775588e-01 -4.894954249e-01 3.72 -8.965794631e-01 -7.128550728e-01 -4.759493573e-01 3.74 -8.875708110e-01 -6.995144978e-01 -4.625936285e-01 3.76 -8.785868373e-01 -6.863535081e-01 -4.494239528e-01 3.78 -8.696217414e-01 -6.733708323e-01 -4.364288758e-01 3.80 -8.606693149e-01 -6.605647292e-01 -4.235978437e-01 3.82 -8.517230559e-01 -6.479341631e-01 -4.109241583e-01 3.84 -8.427763580e-01 -6.354739718e-01 -3.984040410e-01 3.86 -8.338224833e-01 -6.231752087e-01 -3.860357572e-01 3.88 -8.248545782e-01 -6.110316278e-01 -3.738214922e-01 3.90 -8.158656638e-01 -5.990376488e-01 -3.617688031e-01 3.92 -8.068489211e-01 -5.871895663e-01 -3.498754711e-01 3.94 -7.977977026e-01 -5.754845644e-01 -3.381452199e-01 3.96 -7.887055214e-01 -5.639211370e-01 -3.265688521e-01 3.98 -7.795659182e-01 -5.524987549e-01 -3.151218655e-01 4.00 -7.703727831e-01 -5.412172655e-01 -3.037935590e-01 4.02 -7.611204335e-01 -5.300769244e-01 -2.925827206e-01 4.04 -7.518035902e-01 -5.190781889e-01 -2.814904092e-01 4.06 -7.424171969e-01 -5.082215154e-01 -2.705252234e-01 4.08 -7.329565999e-01 -4.975072468e-01 -2.597012870e-01 4.10 -7.234177414e-01 -4.869356898e-01 -2.490345282e-01 4.12 -7.137971803e-01 -4.765070678e-01 -2.385416783e-01 4.14 -7.040919441e-01 -4.662214540e-01 -2.282405637e-01 4.16 -6.942994056e-01 -4.560787440e-01 -2.181493302e-01 4.18 -6.844175666e-01 -4.460787040e-01 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