# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2025--Kushnerov-O-I-Ryabtsev-S-I-Bashev-V-F--Co-Cr-Fe-Ni-Mn-Al # implementation = 2025--Kushnerov-O-I--Co-Cr-Fe-Ni-Mn-Al--LAMMPS--ipr1 # composition = Al # 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 2025-07-01 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 nan nan 0.74 nan nan nan nan nan nan nan nan nan nan 0.76 nan nan nan nan nan nan nan nan nan nan 0.78 nan nan nan nan nan nan nan nan 3.969739796e+02 nan 0.80 nan nan nan nan nan nan nan nan 3.610603954e+02 nan 0.82 nan nan nan nan nan nan nan nan 3.291791880e+02 nan 0.84 nan nan nan nan nan 2.568103780e+02 nan nan 3.002886804e+02 nan 0.86 nan nan nan nan nan 2.343293804e+02 nan nan 2.738863573e+02 nan 0.88 nan nan nan nan nan 2.142197197e+02 nan nan 2.504796345e+02 nan 0.90 nan nan nan nan nan 1.961720431e+02 nan nan 2.290619542e+02 nan 0.92 nan nan nan nan nan 1.794904723e+02 nan nan 2.095912879e+02 nan 0.94 nan nan nan nan nan 1.647534438e+02 nan nan 1.922056948e+02 nan 0.96 nan 2.555250459e+02 nan 3.980609072e+02 3.979745464e+02 1.511870144e+02 nan nan 1.762046749e+02 2.577702593e+02 0.98 nan 2.348823753e+02 nan 3.687721041e+02 3.688187014e+02 1.384527358e+02 2.409320924e+02 nan 1.613889038e+02 2.374862551e+02 1.00 nan 2.163438355e+02 nan 3.411603941e+02 3.411254688e+02 1.274038091e+02 2.217784198e+02 nan 1.480087523e+02 2.193599500e+02 1.02 nan 1.991577490e+02 nan 3.163170686e+02 3.163294126e+02 1.169385814e+02 2.046822351e+02 nan 1.360413973e+02 2.018080891e+02 1.04 nan 1.837711324e+02 nan 2.934810817e+02 2.935443673e+02 1.071980634e+02 1.887791545e+02 nan 1.248550197e+02 1.865554406e+02 1.06 nan 1.693755452e+02 nan 2.721147335e+02 2.721469229e+02 9.863638053e+01 1.743339451e+02 nan 1.146243141e+02 1.720481427e+02 1.08 nan 1.561160990e+02 2.252800907e+02 2.523032622e+02 2.522314443e+02 9.110628099e+01 1.610597570e+02 2.333211625e+02 1.053203485e+02 1.588953286e+02 1.10 2.349817122e+02 1.442259402e+02 2.092964159e+02 2.345969636e+02 2.345291014e+02 8.392159942e+01 1.485047341e+02 2.166295976e+02 9.693794386e+01 1.472347450e+02 1.12 2.178493350e+02 1.328476031e+02 1.938873192e+02 2.177985067e+02 2.177147168e+02 7.723738733e+01 1.374620894e+02 2.008171157e+02 8.909929755e+01 1.358126317e+02 1.14 2.028314030e+02 1.228809655e+02 1.794939824e+02 2.026863030e+02 2.028205257e+02 7.091239929e+01 1.269481238e+02 1.864135054e+02 8.189620958e+01 1.252207087e+02 1.16 1.881391713e+02 1.132790802e+02 1.666231790e+02 1.884202644e+02 1.885432802e+02 6.531783254e+01 1.172420259e+02 1.730665857e+02 7.513781774e+01 1.158914127e+02 1.18 1.747842879e+02 1.046805981e+02 1.545446082e+02 1.750072370e+02 1.750417879e+02 6.018583406e+01 1.084236902e+02 1.608165393e+02 6.906614671e+01 1.074961613e+02 1.20 1.626445126e+02 9.635976174e+01 1.442359013e+02 1.628380050e+02 1.628732742e+02 5.559880457e+01 1.001763278e+02 1.494593543e+02 6.349168459e+01 9.914203833e+01 1.22 1.518203706e+02 8.920377825e+01 1.338490243e+02 1.516868090e+02 1.517184024e+02 5.127812970e+01 9.266320752e+01 1.390050259e+02 5.830272908e+01 9.172138618e+01 1.24 1.411635871e+02 8.208828584e+01 1.240277377e+02 1.411944385e+02 1.411728971e+02 4.709153654e+01 8.544410623e+01 1.292962831e+02 5.355993318e+01 8.522548772e+01 1.26 1.314942885e+02 7.603228555e+01 1.154202597e+02 1.313652089e+02 1.313364968e+02 4.333595175e+01 7.886561079e+01 1.203541498e+02 4.909743194e+01 7.875840102e+01 1.28 1.224102799e+02 6.994995943e+01 1.071645066e+02 1.221014101e+02 1.220357139e+02 3.993563433e+01 7.313523118e+01 1.117281643e+02 4.508597972e+01 7.270048903e+01 1.30 1.137430418e+02 6.472587502e+01 9.960474390e+01 1.137474978e+02 1.137769680e+02 3.695854128e+01 6.763934787e+01 1.037479124e+02 4.142626477e+01 6.721703286e+01 1.32 1.060488944e+02 5.957778694e+01 9.229170787e+01 1.059967534e+02 1.059718124e+02 3.391408462e+01 6.265742333e+01 9.634101617e+01 3.795257306e+01 6.194727091e+01 1.34 9.847900393e+01 5.472063830e+01 8.610894089e+01 9.868588188e+01 9.866394057e+01 3.121524757e+01 5.767169265e+01 8.967146658e+01 3.479916199e+01 5.707675863e+01 1.36 9.164450597e+01 5.049876716e+01 7.975574846e+01 9.183645344e+01 9.192073585e+01 2.862407984e+01 5.320205969e+01 8.325906968e+01 3.190002437e+01 5.276860249e+01 1.38 8.550822814e+01 4.652720509e+01 7.390861491e+01 8.557686508e+01 8.565305073e+01 2.628603575e+01 4.895825378e+01 7.737441762e+01 2.912487980e+01 4.899853836e+01 1.40 7.937307710e+01 4.264545824e+01 6.842810343e+01 7.954064629e+01 7.960952032e+01 2.408051894e+01 4.513343872e+01 7.189153092e+01 2.671876873e+01 4.508123443e+01 1.42 7.386892654e+01 3.925758845e+01 6.333617183e+01 7.386826512e+01 7.387993270e+01 2.204669469e+01 4.162796558e+01 6.669057346e+01 2.434606763e+01 4.165729685e+01 1.44 6.853842412e+01 3.622633450e+01 5.918595276e+01 6.863491518e+01 6.864555321e+01 2.046191900e+01 3.841215088e+01 6.202940670e+01 2.239220098e+01 3.827918083e+01 1.46 6.417357762e+01 3.315418370e+01 5.515275959e+01 6.398994615e+01 6.397805067e+01 1.912713383e+01 3.522104705e+01 5.767842935e+01 2.032982977e+01 3.534926640e+01 1.48 5.949418852e+01 3.026026874e+01 5.096634577e+01 5.943066094e+01 5.942003628e+01 1.746291594e+01 3.233023190e+01 5.349420724e+01 1.845351899e+01 3.243068620e+01 1.50 5.538429582e+01 2.758164563e+01 4.707219171e+01 5.544051769e+01 5.543104541e+01 1.592713822e+01 2.967138285e+01 4.956115877e+01 1.667382910e+01 3.002478589e+01 1.52 5.129896387e+01 2.541338708e+01 4.365622219e+01 5.135039767e+01 5.134196941e+01 1.450949424e+01 2.725163121e+01 4.599552127e+01 1.515556873e+01 2.748962229e+01 1.54 4.789614561e+01 2.319029665e+01 4.066964274e+01 4.779123918e+01 4.773310144e+01 1.340319316e+01 2.501210514e+01 4.260768353e+01 1.363305388e+01 2.554469751e+01 1.56 4.430879671e+01 2.102921983e+01 3.747539817e+01 4.432024451e+01 4.426752814e+01 1.217613574e+01 2.307624049e+01 3.944942904e+01 1.223003915e+01 2.332908206e+01 1.58 4.106833062e+01 1.908089543e+01 3.457145782e+01 4.102677417e+01 4.097898937e+01 1.111284146e+01 2.106736082e+01 3.640415119e+01 1.111905495e+01 2.132742818e+01 1.60 3.793875328e+01 1.722400030e+01 3.179612493e+01 3.800445584e+01 3.806440836e+01 1.006012636e+01 1.934044976e+01 3.353111419e+01 1.001614153e+01 1.941833267e+01 1.62 3.501897691e+01 1.585715305e+01 2.921132390e+01 3.518137120e+01 3.523644956e+01 9.087783520e+00 1.753114329e+01 3.099237104e+01 8.895082201e+00 1.764813398e+01 1.64 3.269858033e+01 1.423552105e+01 2.680357110e+01 3.259466982e+01 3.259473716e+01 8.189609821e+00 1.588909274e+01 2.861754590e+01 7.914325659e+00 1.600663766e+01 1.66 3.012117708e+01 1.273484005e+01 2.476126495e+01 3.017684120e+01 3.022729310e+01 7.359915322e+00 1.433223733e+01 2.633748278e+01 6.959300093e+00 1.448445824e+01 1.68 2.771574204e+01 1.134629651e+01 2.285452260e+01 2.781697552e+01 2.786335994e+01 6.693541337e+00 1.288957115e+01 2.414219603e+01 6.129499312e+00 1.307294823e+01 1.70 2.547049013e+01 1.006176162e+01 2.087496588e+01 2.556345923e+01 2.560610404e+01 5.977245768e+00 1.172456818e+01 2.222897640e+01 5.443378261e+00 1.216418908e+01 1.72 2.337452395e+01 9.083406017e+00 1.903081290e+01 2.356017009e+01 2.359937717e+01 5.315683063e+00 1.047214272e+01 2.044742889e+01 4.710114513e+00 1.091783726e+01 1.74 2.141775900e+01 8.122783525e+00 1.751447825e+01 2.158828296e+01 2.162433013e+01 4.906434486e+00 9.382751623e+00 1.864727166e+01 4.010970428e+00 9.762701622e+00 1.76 2.020136828e+01 7.130425258e+00 1.589779944e+01 2.000185992e+01 1.998412677e+01 4.326142712e+00 8.303029254e+00 1.730482781e+01 3.474378851e+00 8.895796008e+00 1.78 1.844726155e+01 6.162630453e+00 1.439198687e+01 1.826321718e+01 1.824684899e+01 3.790490415e+00 7.404134887e+00 1.571390653e+01 2.901703464e+00 7.887974333e+00 1.80 1.681012745e+01 5.268971583e+00 1.298956454e+01 1.674500076e+01 1.672989746e+01 3.296167137e+00 6.471303451e+00 1.433507371e+01 2.400351233e+00 6.954589708e+00 1.82 1.549553191e+01 4.515291887e+00 1.195023233e+01 1.532885915e+01 1.526160044e+01 2.840120162e+00 5.676252290e+00 1.298166506e+01 1.916285714e+00 6.161507598e+00 1.84 1.405340180e+01 3.749091124e+00 1.071394906e+01 1.389957758e+01 1.383747020e+01 2.419532968e+00 5.113334497e+00 1.168425488e+01 1.499693264e+00 5.356249117e+00 1.86 1.270785490e+01 3.149086449e+00 9.966836946e+00 1.271725380e+01 1.271036076e+01 2.233606658e+00 4.352904793e+00 1.061469405e+01 1.169863792e+00 4.611251361e+00 1.88 1.145258742e+01 2.650305328e+00 8.865636520e+00 1.151342127e+01 1.150713511e+01 1.861145524e+00 3.650464347e+00 9.549755160e+00 7.906209100e-01 3.922315003e+00 1.90 1.049579481e+01 2.085785415e+00 7.841322798e+00 1.047209225e+01 1.043960524e+01 1.518055018e+00 3.001971410e+00 8.558223775e+00 4.192284609e-01 3.499604795e+00 1.92 9.388241566e+00 1.513372071e+00 6.888824386e+00 9.366439767e+00 9.336419936e+00 1.202201715e+00 2.403673571e+00 7.563696427e+00 8.010282918e-02 2.895729235e+00 1.94 8.355686914e+00 9.873010109e-01 6.106315023e+00 8.352785568e+00 8.325048878e+00 1.014507048e+00 1.852085533e+00 6.638318022e+00 -1.769932918e-01 2.338175450e+00 1.96 7.393311130e+00 5.043228364e-01 5.276189331e+00 7.497948038e+00 7.472323746e+00 7.399366141e-01 1.415159128e+00 5.777587094e+00 -4.107441829e-01 1.823743831e+00 1.98 6.496620029e+00 6.141706815e-02 4.505190446e+00 6.593990659e+00 6.570320410e+00 4.876402728e-01 9.960468997e-01 5.045663375e+00 -6.229020504e-01 1.349460222e+00 2.00 5.869928253e+00 -3.442249746e-01 3.789461102e+00 5.856276175e+00 5.834413149e+00 2.560147260e-01 5.575865971e-01 4.436094674e+00 -8.119767736e-01 1.121066268e+00 2.02 5.077739924e+00 -7.152159054e-01 3.125403601e+00 5.065066969e+00 5.044875075e+00 4.357408284e-02 1.547746587e-01 3.731036678e+00 -1.035618291e+00 7.044065687e-01 2.04 4.340482131e+00 -1.053986739e+00 2.509660956e+00 4.430838567e+00 4.514311721e+00 -1.510592260e-01 -7.408004562e-02 3.147250666e+00 -1.238032527e+00 3.211681391e-01 2.06 3.654673541e+00 -1.210795820e+00 1.939099526e+00 3.738853382e+00 3.816733695e+00 -3.291627845e-01 -3.878441677e-01 2.535042297e+00 -1.420800050e+00 -3.094546471e-02 2.08 3.017060442e+00 -1.450086639e+00 1.410793019e+00 3.095480372e+00 3.168136740e+00 -4.919218456e-01 -7.091594800e-01 1.967348393e+00 -1.585387296e+00 -3.540730258e-01 2.10 2.635833731e+00 -1.681326564e+00 1.112841294e+00 2.605638802e+00 2.631344099e+00 -5.503227584e-01 -9.748880476e-01 1.620959984e+00 -1.733155067e+00 -4.760023261e-01 2.12 2.174770994e+00 -1.899056012e+00 7.371422272e-01 2.092651938e+00 2.105820222e+00 -6.422508648e-01 -1.167957801e+00 1.134466690e+00 -1.813836089e+00 -6.709357784e-01 2.14 1.644311798e+00 -2.123322616e+00 3.021663037e-01 1.567501256e+00 1.579741445e+00 -7.741345289e-01 -1.419093631e+00 6.719058397e-01 -1.935072440e+00 -9.351542000e-01 2.16 1.152316146e+00 -2.325772630e+00 -9.929979011e-02 1.080475740e+00 1.091851989e+00 -8.940413519e-01 -1.577767247e+00 2.442903366e-01 -2.042790410e+00 -1.176488277e+00 2.18 6.963664200e-01 -2.507954121e+00 -4.694199551e-01 6.291786686e-01 6.397507623e-01 -1.002827070e+00 -1.755282239e+00 -1.506167151e-01 -2.085381063e+00 -1.396512924e+00 2.20 2.741979340e-01 -2.671310749e+00 -8.102192739e-01 3.125266380e-01 3.223502754e-01 -1.101287365e+00 -1.878651061e+00 -5.149093347e-01 -2.172443067e+00 -1.596697633e+00 2.22 -1.163113587e-01 -2.817189006e+00 -1.123593417e+00 -8.038156204e-02 -7.125449254e-02 -1.190162251e+00 -1.988592938e+00 -8.505483292e-01 -2.248633709e+00 -1.778413777e+00 2.24 -4.256830130e-01 -2.843910143e+00 -1.205447792e+00 -4.177380474e-01 -4.349929099e-01 -1.064270560e+00 -2.155551693e+00 -1.125058657e+00 -2.314787761e+00 -1.840006601e+00 2.26 -7.619453656e-01 -2.964973234e+00 -1.482099329e+00 -7.544982066e-01 -7.707418626e-01 -1.148907376e+00 -2.305848288e+00 -1.410936681e+00 -2.371680937e+00 -1.994998338e+00 2.28 -1.071950665e+00 -3.071678779e+00 -1.735519651e+00 -1.064970861e+00 -1.080261469e+00 -1.225083163e+00 -2.440652092e+00 -1.673197159e+00 -2.420034095e+00 -2.134711875e+00 2.30 -1.357351256e+00 -3.165071167e+00 -1.967216279e+00 -1.350810191e+00 -1.365202743e+00 -1.293401205e+00 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