# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2004--Zhou-X-W-Johnson-R-A-Wadley-H-N-G--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr # implementation = 2004--Zhou-X-W--Cu-Ag-Au-Ni-Pd-Pt-Al-Pb-Fe-Mo-Ta-W-Mg-Co-Ti-Zr--LAMMPS--ipr1 # composition = Co3Cu # 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 2024-04-11 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 nan nan nan 0.68 nan nan nan 0.70 nan nan nan 0.72 nan nan nan 0.74 nan nan nan 0.76 nan nan nan 0.78 nan nan nan 0.80 nan nan nan 0.82 nan nan nan 0.84 nan nan nan 0.86 nan nan nan 0.88 nan nan nan 0.90 nan nan nan 0.92 nan nan nan 0.94 nan nan nan 0.96 nan nan nan 0.98 nan nan nan 1.00 nan nan nan 1.02 nan nan nan 1.04 nan nan nan 1.06 nan nan nan 1.08 nan nan nan 1.10 nan nan nan 1.12 nan nan nan 1.14 1.433803576e+02 nan nan 1.16 1.303011081e+02 nan nan 1.18 1.183781649e+02 nan nan 1.20 1.075069368e+02 nan nan 1.22 9.759258252e+01 nan nan 1.24 8.854878916e+01 nan nan 1.26 8.029698406e+01 nan nan 1.28 7.276528404e+01 1.212247509e+02 1.419118737e+02 1.30 6.588821723e+01 1.109395695e+02 1.302579584e+02 1.32 5.960667063e+01 1.014914556e+02 1.195318800e+02 1.34 5.386692919e+01 9.280811217e+01 1.096564957e+02 1.36 4.861967238e+01 8.482453462e+01 1.005619482e+02 1.38 4.382015284e+01 7.748261450e+01 9.218365725e+01 1.40 3.942893111e+01 7.073006154e+01 8.446173098e+01 1.42 3.541166691e+01 6.451922733e+01 7.734170812e+01 1.44 3.173774186e+01 5.880585382e+01 7.077490796e+01 1.46 2.837908493e+01 5.354836039e+01 6.471761973e+01 1.48 2.531183558e+01 4.870818310e+01 5.912994427e+01 1.50 2.251159195e+01 4.425049630e+01 5.397501686e+01 1.52 1.995555046e+01 4.014428697e+01 4.921875182e+01 1.54 1.762336318e+01 3.636172978e+01 4.482988908e+01 1.56 1.549673519e+01 3.287749790e+01 4.077991364e+01 1.58 1.355886136e+01 2.966835661e+01 3.704273588e+01 1.60 1.179398914e+01 2.671400620e+01 3.359439688e+01 1.62 1.018721525e+01 2.399690593e+01 3.041286356e+01 1.64 8.724521694e+00 2.149887507e+01 2.747811708e+01 1.66 7.392980284e+00 1.920299488e+01 2.477334408e+01 1.68 6.180969217e+00 1.709356165e+01 2.228065784e+01 1.70 5.078246762e+00 1.515609952e+01 1.998312886e+01 1.72 4.075819085e+00 1.337729255e+01 1.786542062e+01 1.74 3.165661490e+00 1.174476216e+01 1.591381813e+01 1.76 2.340432528e+00 1.024687228e+01 1.411603050e+01 1.78 1.593289484e+00 8.872742957e+00 1.246091801e+01 1.80 9.178119899e-01 7.612427833e+00 1.093825679e+01 1.82 3.079831330e-01 6.457050800e+00 9.538546890e+00 1.84 -2.417973917e-01 5.398758823e+00 8.252835828e+00 1.86 -7.366699706e-01 4.430514219e+00 7.072574068e+00 1.88 -1.181275964e+00 3.545834507e+00 5.989570184e+00 1.90 -1.579778041e+00 2.738569328e+00 4.996092998e+00 1.92 -1.935948767e+00 2.002765788e+00 4.085053656e+00 1.94 -2.253273054e+00 1.332648034e+00 3.250106567e+00 1.96 -2.535003333e+00 7.227000725e-01 2.485574069e+00 1.98 -2.784155981e+00 1.677966879e-01 1.786260858e+00 2.00 -3.003485745e+00 -3.366853621e-01 1.147294972e+00 2.02 -3.195480381e+00 -7.948209197e-01 5.640723600e-01 2.04 -3.362389896e+00 -1.210169771e+00 3.229127735e-02 2.06 -3.506278017e+00 -1.585874108e+00 -4.519835571e-01 2.08 -3.629076345e+00 -1.924778614e+00 -8.922837377e-01 2.10 -3.732627285e+00 -2.229530923e+00 -1.291754326e+00 2.12 -3.818708155e+00 -2.502642526e+00 -1.653221362e+00 2.14 -3.889033856e+00 -2.746512045e+00 -1.979288007e+00 2.16 -3.945267754e+00 -2.963421936e+00 -2.272435233e+00 2.18 -3.989102540e+00 -3.155521559e+00 -2.535105642e+00 2.20 -4.021782316e+00 -3.324810056e+00 -2.769749390e+00 2.22 -4.044400264e+00 -3.473130348e+00 -2.978813858e+00 2.24 -4.057954663e+00 -3.602178679e+00 -3.164674248e+00 2.26 -4.063328540e+00 -3.713526081e+00 -3.329530668e+00 2.28 -4.061281213e+00 -3.808643803e+00 -3.475318889e+00 2.30 -4.052640207e+00 -3.888924023e+00 -3.603674520e+00 2.32 -4.037736578e+00 -3.955688502e+00 -3.715957623e+00 2.34 -4.016376340e+00 -4.010181979e+00 -3.813314701e+00 2.36 -3.988499054e+00 -4.053642950e+00 -3.896747795e+00 2.38 -3.954168839e+00 -4.087138988e+00 -3.967171568e+00 2.40 -3.913562022e+00 -4.111422173e+00 -4.025453509e+00 2.42 -3.866958098e+00 -4.127157397e+00 -4.072452939e+00 2.44 -3.814745597e+00 -4.134959241e+00 -4.109155130e+00 2.46 -3.757427337e+00 -4.135409429e+00 -4.136303775e+00 2.48 -3.695563039e+00 -4.129073534e+00 -4.154603815e+00 2.50 -3.629735047e+00 -4.116543557e+00 -4.164797152e+00 2.52 -3.560517051e+00 -4.098450750e+00 -4.167638784e+00 2.54 -3.488448557e+00 -4.074861473e+00 -4.163871215e+00 2.56 -3.414023883e+00 -4.045870715e+00 -4.154202286e+00 2.58 -3.337698037e+00 -4.011706652e+00 -4.139439024e+00 2.60 -3.259904198e+00 -3.972704500e+00 -4.119920009e+00 2.62 -3.181072952e+00 -3.929269019e+00 -4.095682498e+00 2.64 -3.101643047e+00 -3.881831160e+00 -4.066807048e+00 2.66 -3.022056969e+00 -3.830832624e+00 -4.033398337e+00 2.68 -2.942741218e+00 -3.776698062e+00 -3.995574917e+00 2.70 -2.864078687e+00 -3.719801184e+00 -3.953466388e+00 2.72 -2.786384655e+00 -3.660472619e+00 -3.907216020e+00 2.74 -2.709895324e+00 -3.599011623e+00 -3.857002147e+00 2.76 -2.634770470e+00 -3.535693221e+00 -3.803049595e+00 2.78 -2.561105216e+00 -3.470769463e+00 -3.745616078e+00 2.80 -2.488944378e+00 -3.404467371e+00 -3.685002510e+00 2.82 -2.418295331e+00 -3.336987086e+00 -3.621563274e+00 2.84 -2.349138481e+00 -3.268502554e+00 -3.555709526e+00 2.86 -2.281435978e+00 -3.199165279e+00 -3.487900587e+00 2.88 -2.215139191e+00 -3.129110471e+00 -3.418621076e+00 2.90 -2.150194978e+00 -3.058464567e+00 -3.348346847e+00 2.92 -2.086550632e+00 -2.987353296e+00 -3.277508367e+00 2.94 -2.024157506e+00 -2.915909776e+00 -3.206462204e+00 2.96 -1.962973538e+00 -2.844282053e+00 -3.135478208e+00 2.98 -1.902964948e+00 -2.772639091e+00 -3.064743505e+00 3.00 -1.844107293e+00 -2.701173620e+00 -2.994378706e+00 3.02 -1.786385978e+00 -2.630099928e+00 -2.924459295e+00 3.04 -1.729796183e+00 -2.559645318e+00 -2.855036130e+00 3.06 -1.674342193e+00 -2.490035657e+00 -2.786151519e+00 3.08 -1.620036105e+00 -2.421477739e+00 -2.717849702e+00 3.10 -1.566896004e+00 -2.354142887e+00 -2.650182096e+00 3.12 -1.514943732e+00 -2.288156057e+00 -2.583208239e+00 3.14 -1.464202496e+00 -2.223592801e+00 -2.516993548e+00 3.16 -1.414694546e+00 -2.160483662e+00 -2.451605011e+00 3.18 -1.366439126e+00 -2.098823580e+00 -2.387105990e+00 3.20 -1.319450893e+00 -2.038583172e+00 -2.323551259e+00 3.22 -1.273738859e+00 -1.979719378e+00 -2.260983269e+00 3.24 -1.229305888e+00 -1.922184032e+00 -2.199430264e+00 3.26 -1.186148684e+00 -1.865929920e+00 -2.138906419e+00 3.28 -1.144258202e+00 -1.810914545e+00 -2.079413739e+00 3.30 -1.103620338e+00 -1.757102058e+00 -2.020945183e+00 3.32 -1.064216803e+00 -1.704463880e+00 -1.963488419e+00 3.34 -1.026026032e+00 -1.652978424e+00 -1.907029672e+00 3.36 -9.890240514e-01 -1.602630267e+00 -1.851557348e+00 3.38 -9.531851842e-01 -1.553408979e+00 -1.797065191e+00 3.40 -9.184825781e-01 -1.505307794e+00 -1.743554888e+00 3.42 -8.848885142e-01 -1.458322230e+00 -1.691037989e+00 3.44 -8.523745250e-01 -1.412448751e+00 -1.639536939e+00 3.46 -8.209113548e-01 -1.367683535e+00 -1.589084954e+00 3.48 -7.904688163e-01 -1.324021399e+00 -1.539724432e+00 3.50 -7.610155900e-01 -1.281454912e+00 -1.491503754e+00 3.52 -7.325190129e-01 -1.239973729e+00 -1.444472624e+00 3.54 -7.049448861e-01 -1.199564149e+00 -1.398676553e+00 3.56 -6.782573224e-01 -1.160208920e+00 -1.354151417e+00 3.58 -6.524186488e-01 -1.121887286e+00 -1.310919140e+00 3.60 -6.273893694e-01 -1.084575284e+00 -1.268985283e+00 3.62 -6.031281993e-01 -1.048246299e+00 -1.228338851e+00 3.64 -5.795921761e-01 -1.012871858e+00 -1.188954081e+00 3.66 -5.567368625e-01 -9.784226476e-01 -1.150793584e+00 3.68 -5.345166551e-01 -9.448697163e-01 -1.113812104e+00 3.70 -5.128852191e-01 -9.121857832e-01 -1.077960236e+00 3.72 -4.917960711e-01 -8.803465497e-01 -1.043187648e+00 3.74 -4.712033354e-01 -8.493318787e-01 -1.009445574e+00 3.76 -4.510626985e-01 -8.191266846e-01 -9.766885254e-01 3.78 -4.313325814e-01 -7.897213782e-01 -9.448752635e-01 3.80 -4.119755370e-01 -7.611117366e-01 -9.139691553e-01 3.82 -3.929598557e-01 -7.332981345e-01 -8.839380411e-01 3.84 -3.742613280e-01 -7.062841565e-01 -8.547537604e-01 3.86 -3.558650629e-01 -6.800747199e-01 -8.263914634e-01 3.88 -3.377672067e-01 -6.546739276e-01 -7.988288262e-01 3.90 -3.199763564e-01 -6.300829320e-01 -7.720452577e-01 3.92 -3.025144226e-01 -6.062980917e-01 -7.460211682e-01 3.94 -2.854166927e-01 -5.833096501e-01 -7.207373406e-01 3.96 -2.687308776e-01 -5.611010632e-01 -6.961744239e-01 3.98 -2.525150108e-01 -5.396489946e-01 -6.723125559e-01 4.00 -2.368341893e-01 -5.189238938e-01 -6.491311037e-01 4.02 -2.217563073e-01 -4.988910162e-01 -6.266085130e-01 4.04 -2.073471048e-01 -4.795117247e-01 -6.047222471e-01 4.06 -1.936650103e-01 -4.607449315e-01 -5.834488050e-01 4.08 -1.807563596e-01 -4.425485776e-01 -5.627638075e-01 4.10 -1.686515875e-01 -4.248810899e-01 -5.426421459e-01 4.12 -1.573628799e-01 -4.077027915e-01 -5.230581923e-01 4.14 -1.468835609e-01 -3.909772494e-01 -5.039860740e-01 4.16 -1.371892073e-01 -3.746725511e-01 -4.854000189e-01 4.18 -1.282402141e-01 -3.587624687e-01 -4.672747760e-01 4.20 -1.199853497e-01 -3.432274439e-01 -4.495861178e-01 4.22 -1.123657682e-01 -3.280552944e-01 -4.323114214e-01 4.24 -1.053189932e-01 -3.132415274e-01 -4.154303224e-01 4.26 -9.878251310e-02 -2.987891545e-01 -3.989254171e-01 4.28 -9.269676760e-02 -2.847079527e-01 -3.827829774e-01 4.30 -8.700743726e-02 -2.710131884e-01 -3.669936207e-01 4.32 -8.166703546e-02 -2.577239212e-01 -3.515528636e-01 4.34 -7.663584661e-02 -2.448610740e-01 -3.364614705e-01 4.36 -7.188226685e-02 -2.324455042e-01 -3.217255090e-01 4.38 -6.738260212e-02 -2.204962836e-01 -3.073560316e-01 4.40 -6.312037619e-02 -2.090293337e-01 -2.933683344e-01 4.42 -5.908521573e-02 -1.980564677e-01 -2.797807883e-01 4.44 -5.527140670e-02 -1.875848068e-01 -2.666132969e-01 4.46 -5.167625436e-02 -1.776164892e-01 -2.538854962e-01 4.48 -4.829841126e-02 -1.681485830e-01 -2.416148614e-01 4.50 -4.513634751e-02 -1.591731376e-01 -2.298149106e-01 4.52 -4.218711906e-02 -1.506773433e-01 -2.184936926e-01 4.54 -3.944553815e-02 -1.426438027e-01 -2.076527079e-01 4.56 -3.690378445e-02 -1.350509248e-01 -1.972863484e-01 4.58 -3.455142287e-02 -1.278734523e-01 -1.873818801e-01 4.60 -3.237558798e-02 -1.210831145e-01 -1.779199180e-01 4.62 -3.036183091e-02 -1.146493804e-01 -1.688753045e-01 4.64 -2.849480804e-02 -1.085402765e-01 -1.602182716e-01 4.66 -2.675865633e-02 -1.027232279e-01 -1.519157739e-01 4.68 -2.513762071e-02 -9.716589039e-02 -1.439328901e-01 4.70 -2.361657303e-02 -9.183694649e-02 -1.362342202e-01 4.72 -2.218141473e-02 -8.670685580e-02 -1.287852333e-01 4.74 -2.081937313e-02 -8.174855424e-02 -1.215535411e-01 4.76 -1.951919943e-02 -7.693810398e-02 -1.145100870e-01 4.78 -1.827123106e-02 -7.225529235e-02 -1.076302416e-01 4.80 -1.706766641e-02 -6.768416996e-02 -1.008947875e-01 4.82 -1.590254381e-02 -6.321350707e-02 -9.429075934e-02 4.84 -1.477171875e-02 -5.883712796e-02 -8.781208423e-02 4.86 -1.367282709e-02 -5.455407796e-02 -8.145994928e-02 4.88 -1.260519504e-02 -5.036856409e-02 -7.524281433e-02 4.90 -1.156968613e-02 -4.628961806e-02 -6.917599335e-02 4.92 -1.056847813e-02 -4.233044800e-02 -6.328075581e-02 4.94 -9.604770519e-03 -3.850747762e-02 -5.758294720e-02 4.96 -8.682432845e-03 -3.483910473e-02 -5.211119294e-02 4.98 -7.805615414e-03 -3.134411359e-02 -4.689481767e-02 5.00 -6.978353103e-03 -2.804061012e-02 -4.196166799e-02 5.02 -6.204197657e-03 -2.494449418e-02 -3.733606219e-02 5.04 -5.485912423e-03 -2.206819325e-02 -3.303707510e-02 5.06 -4.825255777e-03 -1.941984881e-02 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