# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Ni # implementation = 2004--Zhou-X-W--Ni--LAMMPS--ipr2 # composition = Ni # 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 A1--Cu--fcc A15--beta-W A2--W--bcc A3'--alpha-La--d A3--Mg--hcp A4--C--dc A5--beta-Sn A6--In--bct A7--alpha-As Ah--alpha-Po--sc 0.50 nan nan nan nan nan nan nan nan nan nan 0.52 nan nan nan nan nan nan nan nan nan nan 0.54 nan nan nan nan nan nan nan nan nan nan 0.56 nan nan nan nan nan nan nan nan nan nan 0.58 nan nan nan nan nan nan nan nan nan nan 0.60 nan nan nan nan nan nan nan nan nan nan 0.62 nan nan nan nan nan nan nan nan nan nan 0.64 nan nan nan nan nan nan nan nan nan nan 0.66 nan nan nan nan nan nan nan nan nan nan 0.68 nan nan nan nan nan nan nan nan nan nan 0.70 nan nan nan nan nan nan nan nan nan nan 0.72 nan nan nan nan nan nan nan nan 6.669046276e+02 nan 0.74 nan nan nan nan nan nan nan nan 5.974185008e+02 nan 0.76 nan nan nan nan nan 4.625754541e+02 nan nan 5.358827108e+02 nan 0.78 nan nan nan nan nan 4.160298352e+02 nan nan 4.812673396e+02 nan 0.80 nan nan nan nan nan 3.746122206e+02 nan nan 4.326835510e+02 nan 0.82 nan nan nan nan nan 3.376888783e+02 nan nan 3.893739689e+02 nan 0.84 nan nan nan nan nan 3.047329631e+02 nan nan 3.506992317e+02 nan 0.86 nan nan nan nan nan 2.752778350e+02 nan nan 3.161111754e+02 nan 0.88 nan nan nan 6.798557574e+02 6.798625308e+02 2.489048121e+02 nan nan 2.851353272e+02 4.283270614e+02 0.90 nan 3.796198583e+02 nan 6.201994984e+02 6.201975135e+02 2.252460997e+02 3.923512806e+02 nan 2.573593813e+02 3.886760260e+02 0.92 nan 3.440031094e+02 nan 5.662118371e+02 5.662103409e+02 2.039818020e+02 3.560728779e+02 nan 2.324211168e+02 3.529017918e+02 0.94 nan 3.118675108e+02 nan 5.172847823e+02 5.172920613e+02 1.848360401e+02 3.233167283e+02 nan 2.100013047e+02 3.205877560e+02 0.96 nan 2.828410444e+02 nan 4.728769054e+02 4.728958753e+02 1.675787515e+02 2.936918632e+02 nan 1.898203291e+02 2.913842687e+02 0.98 nan 2.566007329e+02 nan 4.325139409e+02 4.325408548e+02 1.520175338e+02 2.668741476e+02 3.967919004e+02 1.716343314e+02 2.649758328e+02 1.00 3.957425399e+02 2.328567225e+02 3.486034914e+02 3.957869208e+02 3.958138722e+02 1.379818148e+02 2.425846031e+02 3.626379512e+02 1.552283171e+02 2.410684111e+02 1.02 3.623187496e+02 2.113474447e+02 3.185225394e+02 3.623392770e+02 3.623594842e+02 1.253106572e+02 2.205711470e+02 3.315689808e+02 1.404108041e+02 2.193967037e+02 1.04 3.318572179e+02 1.918418588e+02 2.911470170e+02 3.318530853e+02 3.318642009e+02 1.138501766e+02 2.006049901e+02 3.032714192e+02 1.270128054e+02 1.997290741e+02 1.06 3.040579243e+02 1.741399051e+02 2.662026239e+02 3.040394385e+02 3.040426078e+02 1.034614233e+02 1.824816621e+02 2.774650768e+02 1.148887596e+02 1.818617293e+02 1.08 2.786570962e+02 1.580670636e+02 2.434474000e+02 2.786368487e+02 2.786347750e+02 9.402774561e+01 1.660184185e+02 2.539045591e+02 1.039139762e+02 1.656116582e+02 1.10 2.554252876e+02 1.434645539e+02 2.226660587e+02 2.554126196e+02 2.554090435e+02 8.545251933e+01 1.510485991e+02 2.323757343e+02 9.397807011e+01 1.508145956e+02 1.12 2.341619501e+02 1.301879149e+02 2.036678054e+02 2.341624362e+02 2.341616341e+02 7.765232859e+01 1.374200457e+02 2.126915285e+02 8.497964127e+01 1.373278779e+02 1.14 2.146901313e+02 1.181080661e+02 1.862885807e+02 2.147057361e+02 2.147108406e+02 7.055383862e+01 1.249973079e+02 1.946869677e+02 7.682455200e+01 1.250318313e+02 1.16 1.968512969e+02 1.071102876e+02 1.703867260e+02 1.968798842e+02 1.968915563e+02 6.409284079e+01 1.136646148e+02 1.782137482e+02 6.942719683e+01 1.138243588e+02 1.18 1.805011242e+02 9.709329746e+01 1.558337046e+02 1.805369878e+02 1.805535952e+02 5.821214443e+01 1.033244691e+02 1.631356003e+02 6.271215230e+01 1.036124200e+02 1.20 1.655099040e+02 8.796848564e+01 1.425093178e+02 1.655444384e+02 1.655630784e+02 5.285877907e+01 9.389198910e+01 1.493271928e+02 5.661323702e+01 9.430570768e+01 1.22 1.517612809e+02 7.965550711e+01 1.303038337e+02 1.517846723e+02 1.518020633e+02 4.798297769e+01 8.528906909e+01 1.366734608e+02 5.107147752e+01 8.581612816e+01 1.24 1.391461487e+02 7.207859198e+01 1.191194188e+02 1.391517931e+02 1.391653351e+02 4.353856566e+01 7.744240524e+01 1.250683103e+02 4.603396857e+01 7.806208821e+01 1.26 1.275597900e+02 6.516819648e+01 1.088690415e+02 1.275485440e+02 1.275570632e+02 3.948430807e+01 7.028351928e+01 1.144152597e+02 4.145304132e+01 7.097263007e+01 1.28 1.169054962e+02 5.886369048e+01 9.947275853e+01 1.168854060e+02 1.168892470e+02 3.578423070e+01 6.374875604e+01 1.046292228e+02 3.728556076e+01 6.448723621e+01 1.30 1.070995650e+02 5.311277307e+01 9.085458551e+01 1.070810059e+02 1.070814797e+02 3.240644139e+01 5.777905712e+01 9.563652617e+01 3.349248326e+01 5.855372814e+01 1.32 9.807182175e+01 4.786801662e+01 8.294091928e+01 9.806210548e+01 9.806067471e+01 2.932070681e+01 5.232069277e+01 8.737261867e+01 3.003884812e+01 5.312573310e+01 1.34 8.976139533e+01 4.308420547e+01 7.566439961e+01 8.976293249e+01 8.976077173e+01 2.649853320e+01 4.732662048e+01 7.977882036e+01 2.689348519e+01 4.816032661e+01 1.36 8.211330687e+01 3.871855760e+01 6.896786207e+01 8.212447281e+01 8.212253431e+01 2.391426660e+01 4.275699603e+01 7.280083063e+01 2.402855974e+01 4.361736444e+01 1.38 7.507589370e+01 3.473276725e+01 6.280472540e+01 7.509335349e+01 7.509274534e+01 2.154589190e+01 3.857759915e+01 6.638844927e+01 2.141897853e+01 3.945932114e+01 1.40 6.860054019e+01 3.109376101e+01 5.713595481e+01 6.862065430e+01 6.862267972e+01 1.937488319e+01 3.475731155e+01 6.049531371e+01 1.904154402e+01 3.565233025e+01 1.42 6.264147817e+01 2.777272955e+01 5.192650534e+01 6.266096759e+01 6.266667397e+01 1.738539313e+01 3.126660784e+01 5.507836676e+01 1.687473695e+01 3.216602208e+01 1.44 5.715614058e+01 2.474326599e+01 4.714339741e+01 5.717215713e+01 5.718162118e+01 1.556360140e+01 2.807711038e+01 5.009755795e+01 1.489929497e+01 2.897310584e+01 1.46 5.210507028e+01 2.198018984e+01 4.275456089e+01 5.211552762e+01 5.212759677e+01 1.389679402e+01 2.516200398e+01 4.551593149e+01 1.309851103e+01 2.604882464e+01 1.48 4.745216408e+01 1.945951021e+01 3.872824206e+01 4.745599885e+01 4.746863810e+01 1.237274668e+01 2.249645509e+01 4.129997880e+01 1.145785425e+01 2.337040561e+01 1.50 4.316393909e+01 1.715928483e+01 3.503330240e+01 4.316176582e+01 4.317299467e+01 1.097982337e+01 2.005797980e+01 3.741948921e+01 9.964259258e+00 2.091647080e+01 1.52 3.920967912e+01 1.506049299e+01 3.164026772e+01 3.920388051e+01 3.921248949e+01 9.706403335e+00 1.782627746e+01 3.384746635e+01 8.605486009e+00 1.866684146e+01 1.54 3.556218062e+01 1.314693608e+01 2.852248413e+01 3.555599471e+01 3.556166039e+01 8.541693309e+00 1.578305025e+01 3.056021829e+01 7.370246798e+00 1.660349974e+01 1.56 3.219822421e+01 1.140451788e+01 2.565648243e+01 3.219434039e+01 3.219727997e+01 7.475828504e+00 1.391160978e+01 2.753693641e+01 6.248373659e+00 1.471085569e+01 1.58 2.909774192e+01 9.820131387e+00 2.302150309e+01 2.909739421e+01 2.909799330e+01 6.499650111e+00 1.219694675e+01 2.475891978e+01 5.230203835e+00 1.297536940e+01 1.60 2.624302267e+01 8.380901594e+00 2.059865217e+01 2.624579026e+01 2.624438438e+01 5.604399453e+00 1.062583731e+01 2.220853355e+01 4.307112889e+00 1.138492741e+01 1.62 2.361741853e+01 7.073979356e+00 1.837080957e+01 2.362178137e+01 2.361862700e+01 4.782069733e+00 9.186892653e+00 1.986839330e+01 3.471313477e+00 9.928287000e+00 1.64 2.120467754e+01 5.886686007e+00 1.632280510e+01 2.120876709e+01 2.120411490e+01 4.025955609e+00 7.870209922e+00 1.772123298e+01 2.715469584e+00 8.595002658e+00 1.66 1.898861515e+01 4.806932520e+00 1.444138830e+01 1.899067830e+01 1.898483035e+01 3.330725831e+00 6.667080894e+00 1.574997209e+01 2.032382684e+00 7.375508410e+00 1.68 1.695277639e+01 3.823708042e+00 1.271488154e+01 1.695170985e+01 1.694515010e+01 2.692246713e+00 5.569418140e+00 1.393840109e+01 1.414978863e+00 6.261102946e+00 1.70 1.508057011e+01 2.927846821e+00 1.113225787e+01 1.507633100e+01 1.506977875e+01 2.106955636e+00 4.569892662e+00 1.227181396e+01 8.565014859e-01 5.244153509e+00 1.72 1.335629463e+01 2.111432952e+00 9.682611193e+00 1.334992452e+01 1.334424117e+01 1.571497049e+00 3.661257466e+00 1.073755626e+01 3.508770813e-01 4.317516159e+00 1.74 1.176609410e+01 1.368084603e+00 8.354856059e+00 1.175935568e+01 1.175534318e+01 1.082451398e+00 2.836166347e+00 9.325063742e+00 -1.070523966e-01 3.474440605e+00 1.76 1.029865389e+01 6.925582515e-01 7.137959819e+00 1.029332252e+01 1.029151389e+01 6.363153114e-01 2.087411868e+00 8.025448331e+00 -5.215332448e-01 2.708665534e+00 1.78 8.944854934e+00 8.029006921e-02 6.021395165e+00 8.942236881e+00 8.942823568e+00 2.294890354e-01 1.408113715e+00 6.830855198e+00 -8.960234772e-01 2.014119143e+00 1.80 7.697171400e+00 -4.729182436e-01 4.995740642e+00 7.697833756e+00 7.700765053e+00 -1.415442577e-01 7.919749322e-01 5.734042904e+00 -1.233530737e+00 1.384917237e+00 1.82 6.548730700e+00 -9.710352661e-01 4.053088469e+00 6.552612278e+00 6.557711534e+00 -4.799833738e-01 2.333892466e-01 4.728037933e+00 -1.536823296e+00 8.151102505e-01 1.84 5.492913747e+00 -1.417908363e+00 3.187429039e+00 5.499632564e+00 5.506733853e+00 -7.885342735e-01 -2.723971054e-01 3.806268172e+00 -1.808643365e+00 2.988219527e-01 1.86 4.523318962e+00 -1.817196331e+00 2.393772470e+00 4.532344920e+00 4.541257294e+00 -1.069389686e+00 -7.294616371e-01 2.962920529e+00 -2.051754060e+00 -1.694102605e-01 1.88 3.633807356e+00 -2.172480623e+00 1.667575046e+00 3.644591370e+00 3.655032743e+00 -1.324459880e+00 -1.141405259e+00 2.192237243e+00 -2.268866356e+00 -5.944049050e-01 1.90 2.819113263e+00 -2.487278007e+00 1.004670879e+00 2.830976403e+00 2.842450876e+00 -1.555463650e+00 -1.511537445e+00 1.488805743e+00 -2.462539135e+00 -9.799378328e-01 1.92 2.074021342e+00 -2.765129625e+00 4.008215053e-01 2.086143201e+00 2.097920157e+00 -1.764173814e+00 -1.842976515e+00 8.475297867e-01 -2.635052027e+00 -1.329017296e+00 1.94 1.393603651e+00 -3.009599422e+00 -1.482997921e-01 1.405079597e+00 1.416273251e+00 -1.952439248e+00 -2.138793684e+00 2.636550719e-01 -2.788395223e+00 -1.644156809e+00 1.96 7.731271292e-01 -3.224212186e+00 -6.470155214e-01 7.830499623e-01 7.927655671e-01 -2.122134405e+00 -2.401921655e+00 -2.672443683e-01 -2.924305682e+00 -1.927732501e+00 1.98 2.079427433e-01 -3.412318751e+00 -1.099461568e+00 2.155803823e-01 2.230717193e-01 -2.275016001e+00 -2.635238944e+00 -7.493065708e-01 -3.044291258e+00 -2.182228465e+00 2.00 -3.065589298e-01 -3.576998303e+00 -1.509532339e+00 -3.016581122e-01 -2.968581330e-01 -2.412733550e+00 -2.841415076e+00 -1.186441745e+00 -3.149729516e+00 -2.410362659e+00 2.02 -7.748068237e-01 -3.720872440e+00 -1.880655794e+00 -7.727768763e-01 -7.708154373e-01 -2.536623724e+00 -3.022986090e+00 -1.582304487e+00 -3.241914940e+00 -2.614902035e+00 2.04 -1.200884555e+00 -3.846107928e+00 -2.215899564e+00 -1.201569299e+00 -1.202300209e+00 -2.647831812e+00 -3.182361812e+00 -1.940242868e+00 -3.322081623e+00 -2.798480910e+00 2.06 -1.588347678e+00 -3.954482526e+00 -2.517978840e+00 -1.591387630e+00 -1.594464695e+00 -2.747316859e+00 -3.321845974e+00 -2.263293336e+00 -3.391387281e+00 -2.963346487e+00 2.08 -1.940169884e+00 -4.047365690e+00 -2.789306666e+00 -1.945138012e+00 -1.950131027e+00 -2.835889139e+00 -3.443636470e+00 -2.554078113e+00 -3.450890906e+00 -3.111243234e+00 2.10 -2.258832060e+00 -4.125950885e+00 -3.032037986e+00 -2.265306578e+00 -2.271797807e+00 -2.913876758e+00 -3.549761291e+00 -2.814990407e+00 -3.501460339e+00 -3.243457052e+00 2.12 -2.546450842e+00 -4.191215628e+00 -3.248106523e+00 -2.554091670e+00 -2.561733920e+00 -2.981065575e+00 -3.642055318e+00 -3.048251904e+00 -3.543853274e+00 -3.360961545e+00 2.14 -2.805111296e+00 -4.244075166e+00 -3.439261317e+00 -2.813619545e+00 -2.822128718e+00 -3.037342319e+00 -3.722134527e+00 -3.255963207e+00 -3.578392438e+00 -3.464579034e+00 2.16 -3.036701061e+00 -4.285403125e+00 -3.607084446e+00 -3.045844830e+00 -3.054989197e+00 -3.082719794e+00 -3.791384826e+00 -3.440217259e+00 -3.604715024e+00 -3.555100574e+00 2.18 -3.243173540e+00 -4.316060677e+00 -3.753150873e+00 -3.252747351e+00 -3.262321548e+00 -3.117315642e+00 -3.850948367e+00 -3.603075526e+00 -3.622568621e+00 -3.633353423e+00 2.20 -3.426510313e+00 -4.336898385e+00 -3.878905089e+00 -3.436268204e+00 -3.446026343e+00 -3.141342828e+00 -3.901727790e+00 -3.746527764e+00 -3.631877099e+00 -3.700227391e+00 2.22 -3.588713236e+00 -4.348774259e+00 -3.985815282e+00 -3.598335181e+00 -3.607963145e+00 -3.155093526e+00 -3.944420155e+00 -3.872432355e+00 -3.632740955e+00 -3.756662237e+00 2.24 -3.731767959e+00 -4.352546792e+00 -4.075467896e+00 -3.740860068e+00 -3.749956329e+00 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