# 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 = CoPb3 # 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 4.240176874e+02 nan nan 1.16 3.935808012e+02 nan nan 1.18 3.654696700e+02 nan nan 1.20 3.394843520e+02 nan nan 1.22 3.154442733e+02 nan nan 1.24 2.931858607e+02 nan nan 1.26 2.725610276e+02 nan nan 1.28 2.534360332e+02 3.737221695e+02 4.221146234e+02 1.30 2.356898084e+02 3.492001910e+02 3.949467166e+02 1.32 2.192122211e+02 3.263779060e+02 3.696380865e+02 1.34 2.039031886e+02 3.051215848e+02 3.460445443e+02 1.36 1.896720931e+02 2.853084689e+02 3.240352740e+02 1.38 1.764367818e+02 2.668266497e+02 3.034920621e+02 1.40 1.641220351e+02 2.495751773e+02 2.843077963e+02 1.42 1.526582273e+02 2.334635199e+02 2.663842642e+02 1.44 1.419807354e+02 2.184102416e+02 2.496303483e+02 1.46 1.320300316e+02 2.043412554e+02 2.339612814e+02 1.48 1.227517792e+02 1.911880785e+02 2.192986121e+02 1.50 1.140965017e+02 1.788865540e+02 2.055701386e+02 1.52 1.060189810e+02 1.673763018e+02 1.927095024e+02 1.54 9.847768961e+01 1.566007580e+02 1.806556394e+02 1.56 9.143444295e+01 1.465074019e+02 1.693522704e+02 1.58 8.486401745e+01 1.370478866e+02 1.587475866e+02 1.60 7.875065522e+01 1.281779696e+02 1.487940331e+02 1.62 7.306180102e+01 1.198573040e+02 1.394480259e+02 1.64 6.776698072e+01 1.120491144e+02 1.306695999e+02 1.66 6.283803197e+01 1.047198013e+02 1.224219880e+02 1.68 5.824886593e+01 9.783844674e+01 1.146711371e+02 1.70 5.397522360e+01 9.137627224e+01 1.073852527e+02 1.72 4.999452868e+01 8.531291321e+01 1.005344392e+02 1.74 4.628582371e+01 7.963856635e+01 9.409054656e+01 1.76 4.282975788e+01 7.432797472e+01 8.802814818e+01 1.78 3.960856315e+01 6.935667410e+01 8.233854228e+01 1.80 3.660597422e+01 6.470194927e+01 7.700265932e+01 1.82 3.380709780e+01 6.034273383e+01 7.199727276e+01 1.84 3.119824888e+01 5.625950395e+01 6.730097052e+01 1.86 2.876676410e+01 5.243414975e+01 6.289406558e+01 1.88 2.650083684e+01 4.884989962e+01 5.875844980e+01 1.90 2.438940335e+01 4.549123408e+01 5.487737121e+01 1.92 2.242208488e+01 4.234378548e+01 5.123520628e+01 1.94 2.058917567e+01 3.939421385e+01 4.781725533e+01 1.96 1.888163210e+01 3.663008329e+01 4.460963202e+01 1.98 1.729104438e+01 3.403974682e+01 4.159921449e+01 2.00 1.580958711e+01 3.161225718e+01 3.877362649e+01 2.02 1.442997107e+01 2.933731504e+01 3.612123865e+01 2.04 1.314539252e+01 2.720524358e+01 3.363116633e+01 2.06 1.194951023e+01 2.520698058e+01 3.129326316e+01 2.08 1.083642312e+01 2.333407415e+01 2.909809657e+01 2.10 9.800654114e+00 2.157867023e+01 2.703691589e+01 2.12 8.837129859e+00 1.993348884e+01 2.510160566e+01 2.14 7.941152744e+00 1.839178918e+01 2.328463001e+01 2.16 7.108367302e+00 1.694732268e+01 2.157897093e+01 2.18 6.334713050e+00 1.559428247e+01 1.997806465e+01 2.20 5.616389185e+00 1.432724636e+01 1.847574519e+01 2.22 4.949817922e+00 1.314113143e+01 1.706619234e+01 2.24 4.331625574e+00 1.203115346e+01 1.574389687e+01 2.26 3.758633787e+00 1.099279541e+01 1.450363423e+01 2.28 3.227857895e+00 1.002178214e+01 1.334045431e+01 2.30 2.736506062e+00 9.114059799e+00 1.224967341e+01 2.32 2.281975988e+00 8.265778400e+00 1.122687918e+01 2.34 1.861846075e+00 7.473280104e+00 1.026793160e+01 2.36 1.473857807e+00 6.733090857e+00 9.368962439e+00 2.38 1.115901634e+00 6.041917116e+00 8.526369852e+00 2.40 7.859665831e-01 5.396645752e+00 7.736808193e+00 2.42 4.821812771e-01 4.794346538e+00 6.997170804e+00 2.44 2.028315165e-01 4.232273371e+00 6.304567671e+00 2.46 -5.370741220e-02 3.707865554e+00 5.656300084e+00 2.48 -2.889710437e-01 3.218745365e+00 5.049835655e+00 2.50 -5.044044694e-01 2.762712186e+00 4.482788273e+00 2.52 -7.013613583e-01 2.337732842e+00 3.952900535e+00 2.54 -8.811044974e-01 1.941928541e+00 3.458033555e+00 2.56 -1.044804125e+00 1.573559237e+00 2.996158061e+00 2.58 -1.193500740e+00 1.231006650e+00 2.565347427e+00 2.60 -1.328156551e+00 9.127558165e-01 2.163771805e+00 2.62 -1.449685698e+00 6.173486928e-01 1.789693797e+00 2.64 -1.558960760e+00 3.434544449e-01 1.441462210e+00 2.66 -1.656813724e+00 8.983202245e-02 1.117512085e+00 2.68 -1.744037900e+00 -1.447035326e-01 8.163449691e-01 2.70 -1.821387479e+00 -3.612827440e-01 5.365288850e-01 2.72 -1.889576986e+00 -5.609833667e-01 2.767645515e-01 2.74 -1.949280787e+00 -7.448315527e-01 3.582292549e-02 2.76 -2.001132753e+00 -9.138025857e-01 -1.874584023e-01 2.78 -2.045725706e+00 -1.068820624e+00 -3.941742051e-01 2.80 -2.083613313e+00 -1.210741589e+00 -5.853517966e-01 2.82 -2.115308531e+00 -1.340337838e+00 -7.619522373e-01 2.84 -2.141287506e+00 -1.458339246e+00 -9.248740648e-01 2.86 -2.161990967e+00 -1.565436939e+00 -1.074955594e+00 2.88 -2.177829726e+00 -1.662283769e+00 -1.212952163e+00 2.90 -2.189181537e+00 -1.749495771e+00 -1.339553104e+00 2.92 -2.196394911e+00 -1.827654629e+00 -1.455409930e+00 2.94 -2.199793162e+00 -1.897311055e+00 -1.561137337e+00 2.96 -2.199687016e+00 -1.958988869e+00 -1.657312566e+00 2.98 -2.196447848e+00 -2.013189357e+00 -1.744485665e+00 3.00 -2.190248142e+00 -2.060395266e+00 -1.823170763e+00 3.02 -2.181230192e+00 -2.101073679e+00 -1.893858865e+00 3.04 -2.169546654e+00 -2.135676044e+00 -1.957019133e+00 3.06 -2.155357938e+00 -2.164642162e+00 -2.013101464e+00 3.08 -2.138829276e+00 -2.188390704e+00 -2.062537746e+00 3.10 -2.120127777e+00 -2.207322254e+00 -2.105741932e+00 3.12 -2.099419368e+00 -2.221815256e+00 -2.143109326e+00 3.14 -2.076851778e+00 -2.232231197e+00 -2.175015637e+00 3.16 -2.052549153e+00 -2.238907488e+00 -2.201816218e+00 3.18 -2.026640095e+00 -2.242164592e+00 -2.223845770e+00 3.20 -1.999259812e+00 -2.242304988e+00 -2.241418190e+00 3.22 -1.970550346e+00 -2.239634158e+00 -2.254828638e+00 3.24 -1.940660235e+00 -2.234473073e+00 -2.264352103e+00 3.26 -1.909743011e+00 -2.227028286e+00 -2.270246096e+00 3.28 -1.877954345e+00 -2.217439199e+00 -2.272751391e+00 3.30 -1.845448056e+00 -2.205837582e+00 -2.272093366e+00 3.32 -1.812371626e+00 -2.192349762e+00 -2.268509431e+00 3.34 -1.778861205e+00 -2.177095914e+00 -2.262270172e+00 3.36 -1.745041804e+00 -2.160190344e+00 -2.253494306e+00 3.38 -1.711020142e+00 -2.141742202e+00 -2.242295196e+00 3.40 -1.676888007e+00 -2.121852738e+00 -2.228796913e+00 3.42 -1.642721048e+00 -2.100606551e+00 -2.213134884e+00 3.44 -1.608584086e+00 -2.078077213e+00 -2.195456660e+00 3.46 -1.574526963e+00 -2.054337023e+00 -2.175922234e+00 3.48 -1.540590964e+00 -2.029459711e+00 -2.154703373e+00 3.50 -1.506808820e+00 -2.003519424e+00 -2.131978049e+00 3.52 -1.473211016e+00 -1.976589920e+00 -2.107920271e+00 3.54 -1.439821019e+00 -1.948744041e+00 -2.082687654e+00 3.56 -1.406661613e+00 -1.920053488e+00 -2.056440014e+00 3.58 -1.373754897e+00 -1.890588953e+00 -2.029330128e+00 3.60 -1.341123162e+00 -1.860420590e+00 -2.001497863e+00 3.62 -1.308789350e+00 -1.829618767e+00 -1.973066131e+00 3.64 -1.276777183e+00 -1.798254994e+00 -1.944139046e+00 3.66 -1.245110987e+00 -1.766402868e+00 -1.914802224e+00 3.68 -1.213815335e+00 -1.734138812e+00 -1.885124758e+00 3.70 -1.182914563e+00 -1.701542401e+00 -1.855162268e+00 3.72 -1.152432261e+00 -1.668696082e+00 -1.824960355e+00 3.74 -1.122390783e+00 -1.635684206e+00 -1.794557932e+00 3.76 -1.092810829e+00 -1.602591400e+00 -1.763990069e+00 3.78 -1.063711124e+00 -1.569500486e+00 -1.733290160e+00 3.80 -1.035108194e+00 -1.536490222e+00 -1.702491378e+00 3.82 -1.007016249e+00 -1.503633232e+00 -1.671627454e+00 3.84 -9.794471492e-01 -1.470994391e+00 -1.640732923e+00 3.86 -9.524104350e-01 -1.438629874e+00 -1.609842958e+00 3.88 -9.259134108e-01 -1.406586882e+00 -1.578992942e+00 3.90 -8.999612503e-01 -1.374903984e+00 -1.548217899e+00 3.92 -8.745561850e-01 -1.343610873e+00 -1.517550487e+00 3.94 -8.497015016e-01 -1.312733588e+00 -1.487026241e+00 3.96 -8.253955247e-01 -1.282288952e+00 -1.456673914e+00 3.98 -8.016359994e-01 -1.252290237e+00 -1.426521487e+00 4.00 -7.784190164e-01 -1.222746800e+00 -1.396594191e+00 4.02 -7.557390627e-01 -1.193664803e+00 -1.366914328e+00 4.04 -7.335890636e-01 -1.165047781e+00 -1.337501222e+00 4.06 -7.119604224e-01 -1.136897103e+00 -1.308371268e+00 4.08 -6.908430679e-01 -1.109212372e+00 -1.279538098e+00 4.10 -6.702255193e-01 -1.081988693e+00 -1.251012841e+00 4.12 -6.500949798e-01 -1.055229954e+00 -1.222804483e+00 4.14 -6.304374703e-01 -1.028928950e+00 -1.194920295e+00 4.16 -6.112380171e-01 -1.003082027e+00 -1.167366344e+00 4.18 -5.924809045e-01 -9.776857797e-01 -1.140148026e+00 4.20 -5.741475231e-01 -9.527374810e-01 -1.113270610e+00 4.22 -5.562271630e-01 -9.282354541e-01 -1.086739737e+00 4.24 -5.387012269e-01 -9.041793170e-01 -1.060561827e+00 4.26 -5.215552511e-01 -8.805700485e-01 -1.034744345e+00 4.28 -5.047765511e-01 -8.574098379e-01 -1.009295887e+00 4.30 -4.883549139e-01 -8.347017175e-01 -9.842260719e-01 4.32 -4.722832577e-01 -8.124490183e-01 -9.595452296e-01 4.34 -4.565581749e-01 -7.906547287e-01 -9.352639383e-01 4.36 -4.411797802e-01 -7.693208605e-01 -9.113924603e-01 4.38 -4.261537277e-01 -7.484479234e-01 -8.879401555e-01 4.40 -4.114876838e-01 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-2.130999176e-01 -4.303943709e-01 -5.219192741e-01 4.78 -2.050297770e-01 -4.171211555e-01 -5.063894125e-01 4.80 -1.971576479e-01 -4.041276234e-01 -4.911773335e-01 4.82 -1.894738544e-01 -3.914122350e-01 -4.762794050e-01 4.84 -1.819715276e-01 -3.789675556e-01 -4.616941011e-01 4.86 -1.746466208e-01 -3.667902478e-01 -4.474222180e-01 4.88 -1.674978348e-01 -3.548785717e-01 -4.334669603e-01 4.90 -1.605264437e-01 -3.432323549e-01 -4.198338556e-01 4.92 -1.537360078e-01 -3.318528329e-01 -4.065304647e-01 4.94 -1.471319701e-01 -3.207423569e-01 -3.935658807e-01 4.96 -1.407211450e-01 -3.099039822e-01 -3.809500360e-01 4.98 -1.345111182e-01 -2.993409755e-01 -3.686928708e-01 5.00 -1.285095929e-01 -2.890562939e-01 -3.568034415e-01 5.02 -1.227237279e-01 -2.790521010e-01 -3.452890645e-01 5.04 -1.171595156e-01 -2.693293805e-01 -3.341545893e-01 5.06 -1.118212527e-01 -2.598876972e-01 -3.234018766e-01 5.08 -1.067111427e-01 -2.507251290e-01 -3.130295262e-01 5.10 -1.018290567e-01 -2.418383702e-01 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-1.237988453e-01 -1.727804665e-01 5.48 -4.208016763e-02 -1.193065913e-01 -1.674708955e-01 5.50 -4.011432063e-02 -1.149917080e-01 -1.622945291e-01 5.52 -3.823527090e-02 -1.108445064e-01 -1.572435612e-01 5.54 -3.644112284e-02 -1.068549010e-01 -1.523092898e-01 5.56 -3.472979991e-02 -1.030125823e-01 -1.474869637e-01 5.58 -3.309893671e-02 -9.930717825e-02 -1.427681567e-01 5.60 -3.154573915e-02 -9.572839946e-02 -1.381460115e-01 5.62 -3.006704315e-02 -9.226616441e-02 -1.336138573e-01 5.64 -2.865941954e-02 -8.891070358e-02 -1.291652086e-01 5.66 -2.731922033e-02 -8.565264442e-02 -1.247937757e-01 5.68 -2.604252511e-02 -8.248307844e-02 -1.204934841e-01 5.70 -2.482522072e-02 -7.939361605e-02 -1.162585071e-01 5.72 -2.366308743e-02 -7.637643184e-02 -1.120833083e-01 5.74 -2.255188616e-02 -7.342430386e-02 -1.079626967e-01 5.76 -2.148744194e-02 -7.053065052e-02 -1.038918941e-01 5.78 -2.046572059e-02 -6.768956742e-02 -9.986661308e-02 5.80 -1.948289663e-02 -6.489586492e-02 -9.588314327e-02 5.82 -1.853541157e-02 -6.214510924e-02 -9.193844860e-02 5.84 -1.762002227e-02 -5.943366513e-02 -8.803026941e-02 5.86 -1.673383965e-02 -5.675873929e-02 -8.415722587e-02 5.88 -1.587435801e-02 -5.411842199e-02 -8.031891830e-02 5.90 -1.503947536e-02 -5.151172349e-02 -7.651601822e-02 5.92 -1.422750489e-02 -4.893860114e-02 -7.275034320e-02 5.94 -1.343717755e-02 -4.639996108e-02 -6.902490818e-02 5.96 -1.266763539e-02 -4.389741963e-02 -6.534394607e-02 5.98 -1.191841567e-02 -4.143372547e-02 -6.171288613e-02 6.00 -1.118942504e-02 -3.901261224e-02 -5.813828892e-02