# 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 = CoFeNi2 # 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 L2_1--AlCu2Mn--h L2_1--AlCu2Mn--h 0.50 nan nan 0.52 nan nan 0.54 nan nan 0.56 nan nan 0.58 nan nan 0.60 nan nan 0.62 nan nan 0.64 nan nan 0.66 nan nan 0.68 nan nan 0.70 nan nan 0.72 nan nan 0.74 nan nan 0.76 nan nan 0.78 nan nan 0.80 nan nan 0.82 nan nan 0.84 nan nan 0.86 nan nan 0.88 nan nan 0.90 nan nan 0.92 nan nan 0.94 nan nan 0.96 nan nan 0.98 nan nan 1.00 nan nan 1.02 nan nan 1.04 nan nan 1.06 nan nan 1.08 nan nan 1.10 nan nan 1.12 nan nan 1.14 nan nan 1.16 nan nan 1.18 nan nan 1.20 nan nan 1.22 nan nan 1.24 nan nan 1.26 nan nan 1.28 1.272388475e+02 1.272388475e+02 1.30 1.160536788e+02 1.160536788e+02 1.32 1.058045187e+02 1.058045187e+02 1.34 9.640412386e+01 9.640412386e+01 1.36 8.777649927e+01 8.777649927e+01 1.38 7.985656901e+01 7.985656901e+01 1.40 7.258761742e+01 7.258761742e+01 1.42 6.591864652e+01 6.591864652e+01 1.44 5.980260209e+01 5.980260209e+01 1.46 5.419547025e+01 5.419547025e+01 1.48 4.905605051e+01 4.905605051e+01 1.50 4.434604747e+01 4.434604747e+01 1.52 4.003016827e+01 4.003016827e+01 1.54 3.607611261e+01 3.607611261e+01 1.56 3.245435423e+01 3.245435423e+01 1.58 2.913771401e+01 2.913771401e+01 1.60 2.610098904e+01 2.610098904e+01 1.62 2.332157556e+01 2.332157556e+01 1.64 2.077845005e+01 2.077845005e+01 1.66 1.845214596e+01 1.845214596e+01 1.68 1.632484754e+01 1.632484754e+01 1.70 1.438008766e+01 1.438008766e+01 1.72 1.260247967e+01 1.260247967e+01 1.74 1.097754985e+01 1.097754985e+01 1.76 9.491752067e+00 9.491752067e+00 1.78 8.132663775e+00 8.132663775e+00 1.80 6.889225925e+00 6.889225925e+00 1.82 5.751851283e+00 5.751851283e+00 1.84 4.712314828e+00 4.712314828e+00 1.86 3.763462585e+00 3.763462585e+00 1.88 2.898850057e+00 2.898850057e+00 1.90 2.112424943e+00 2.112424943e+00 1.92 1.398323801e+00 1.398323801e+00 1.94 7.508001075e-01 7.508001075e-01 1.96 1.642615537e-01 1.642615537e-01 1.98 -3.666311942e-01 -3.666311942e-01 2.00 -8.468574458e-01 -8.468574458e-01 2.02 -1.280959142e+00 -1.280959142e+00 2.04 -1.673008384e+00 -1.673008384e+00 2.06 -2.026615890e+00 -2.026615890e+00 2.08 -2.344966437e+00 -2.344966437e+00 2.10 -2.630867997e+00 -2.630867997e+00 2.12 -2.886806913e+00 -2.886806913e+00 2.14 -3.115005052e+00 -3.115005052e+00 2.16 -3.317475355e+00 -3.317475355e+00 2.18 -3.496072649e+00 -3.496072649e+00 2.20 -3.652537673e+00 -3.652537673e+00 2.22 -3.788532741e+00 -3.788532741e+00 2.24 -3.905667124e+00 -3.905667124e+00 2.26 -4.005511314e+00 -4.005511314e+00 2.28 -4.089602520e+00 -4.089602520e+00 2.30 -4.159445229e+00 -4.159445229e+00 2.32 -4.216506589e+00 -4.216506589e+00 2.34 -4.262203436e+00 -4.262203436e+00 2.36 -4.297918024e+00 -4.297918024e+00 2.38 -4.324798310e+00 -4.324798310e+00 2.40 -4.343794826e+00 -4.343794826e+00 2.42 -4.355690795e+00 -4.355690795e+00 2.44 -4.361110253e+00 -4.361110253e+00 2.46 -4.360551402e+00 -4.360551402e+00 2.48 -4.354429481e+00 -4.354429481e+00 2.50 -4.343051016e+00 -4.343051016e+00 2.52 -4.326383339e+00 -4.326383339e+00 2.54 -4.304305384e+00 -4.304305384e+00 2.56 -4.276814910e+00 -4.276814910e+00 2.58 -4.244013053e+00 -4.244013053e+00 2.60 -4.206083486e+00 -4.206083486e+00 2.62 -4.163270548e+00 -4.163270548e+00 2.64 -4.115850308e+00 -4.115850308e+00 2.66 -4.064032050e+00 -4.064032050e+00 2.68 -4.008011361e+00 -4.008011361e+00 2.70 -3.948038199e+00 -3.948038199e+00 2.72 -3.884418199e+00 -3.884418199e+00 2.74 -3.817510365e+00 -3.817510365e+00 2.76 -3.747717018e+00 -3.747717018e+00 2.78 -3.675464991e+00 -3.675464991e+00 2.80 -3.601181619e+00 -3.601181619e+00 2.82 -3.525271594e+00 -3.525271594e+00 2.84 -3.448100071e+00 -3.448100071e+00 2.86 -3.369984429e+00 -3.369984429e+00 2.88 -3.291193758e+00 -3.291193758e+00 2.90 -3.211953381e+00 -3.211953381e+00 2.92 -3.132451604e+00 -3.132451604e+00 2.94 -3.052846900e+00 -3.052846900e+00 2.96 -2.973274746e+00 -2.973274746e+00 2.98 -2.893853808e+00 -2.893853808e+00 3.00 -2.814691172e+00 -2.814691172e+00 3.02 -2.735886158e+00 -2.735886158e+00 3.04 -2.657532260e+00 -2.657532260e+00 3.06 -2.579717317e+00 -2.579717317e+00 3.08 -2.502522678e+00 -2.502522678e+00 3.10 -2.426022717e+00 -2.426022717e+00 3.12 -2.350285955e+00 -2.350285955e+00 3.14 -2.275378309e+00 -2.275378309e+00 3.16 -2.201368007e+00 -2.201368007e+00 3.18 -2.128330986e+00 -2.128330986e+00 3.20 -2.056355402e+00 -2.056355402e+00 3.22 -1.985544129e+00 -1.985544129e+00 3.24 -1.916014669e+00 -1.916014669e+00 3.26 -1.847896349e+00 -1.847896349e+00 3.28 -1.781325177e+00 -1.781325177e+00 3.30 -1.716436999e+00 -1.716436999e+00 3.32 -1.653359839e+00 -1.653359839e+00 3.34 -1.592206362e+00 -1.592206362e+00 3.36 -1.533067367e+00 -1.533067367e+00 3.38 -1.476006995e+00 -1.476006995e+00 3.40 -1.421060086e+00 -1.421060086e+00 3.42 -1.368231757e+00 -1.368231757e+00 3.44 -1.317498993e+00 -1.317498993e+00 3.46 -1.268813809e+00 -1.268813809e+00 3.48 -1.222107446e+00 -1.222107446e+00 3.50 -1.177295042e+00 -1.177295042e+00 3.52 -1.134280314e+00 -1.134280314e+00 3.54 -1.092959884e+00 -1.092959884e+00 3.56 -1.053227049e+00 -1.053227049e+00 3.58 -1.014974880e+00 -1.014974880e+00 3.60 -9.780986792e-01 -9.780986792e-01 3.62 -9.424978641e-01 -9.424978641e-01 3.64 -9.080774208e-01 -9.080774208e-01 3.66 -8.747490638e-01 -8.747490638e-01 3.68 -8.424322534e-01 -8.424322534e-01 3.70 -8.110551849e-01 -8.110551849e-01 3.72 -7.805558168e-01 -7.805558168e-01 3.74 -7.508829399e-01 -7.508829399e-01 3.76 -7.219972054e-01 -7.219972054e-01 3.78 -6.938719511e-01 -6.938719511e-01 3.80 -6.664935937e-01 -6.664935937e-01 3.82 -6.398613201e-01 -6.398613201e-01 3.84 -6.139858398e-01 -6.139858398e-01 3.86 -5.888870622e-01 -5.888870622e-01 3.88 -5.645907355e-01 -5.645907355e-01 3.90 -5.411243072e-01 -5.411243072e-01 3.92 -5.185124606e-01 -5.185124606e-01 3.94 -4.967729063e-01 -4.967729063e-01 3.96 -4.759129917e-01 -4.759129917e-01 3.98 -4.559275494e-01 -4.559275494e-01 4.00 -4.367981656e-01 -4.367981656e-01 4.02 -4.184937948e-01 -4.184937948e-01 4.04 -4.009724440e-01 -4.009724440e-01 4.06 -3.841835434e-01 -3.841835434e-01 4.08 -3.680706144e-01 -3.680706144e-01 4.10 -3.525739150e-01 -3.525739150e-01 4.12 -3.376328508e-01 -3.376328508e-01 4.14 -3.231880401e-01 -3.231880401e-01 4.16 -3.091830121e-01 -3.091830121e-01 4.18 -2.955655593e-01 -2.955655593e-01 4.20 -2.822887913e-01 -2.822887913e-01 4.22 -2.693119320e-01 -2.693119320e-01 4.24 -2.566008939e-01 -2.566008939e-01 4.26 -2.441286530e-01 -2.441286530e-01 4.28 -2.318754488e-01 -2.318754488e-01 4.30 -2.198288379e-01 -2.198288379e-01 4.32 -2.079836460e-01 -2.079836460e-01 4.34 -1.963418569e-01 -1.963418569e-01 4.36 -1.849124632e-01 -1.849124632e-01 4.38 -1.737112619e-01 -1.737112619e-01 4.40 -1.627605256e-01 -1.627605256e-01 4.42 -1.520884335e-01 -1.520884335e-01 4.44 -1.417281342e-01 -1.417281342e-01 4.46 -1.317163414e-01 -1.317163414e-01 4.48 -1.220914410e-01 -1.220914410e-01 4.50 -1.128911969e-01 -1.128911969e-01 4.52 -1.041502495e-01 -1.041502495e-01 4.54 -9.589767380e-02 -9.589767380e-02 4.56 -8.815488943e-02 -8.815488943e-02 4.58 -8.093416747e-02 -8.093416747e-02 4.60 -7.423789128e-02 -7.423789128e-02 4.62 -6.805860988e-02 -6.805860988e-02 4.64 -6.237981117e-02 -6.237981117e-02 4.66 -5.717725598e-02 -5.717725598e-02 4.68 -5.242066946e-02 -5.242066946e-02 4.70 -4.807559660e-02 -4.807559660e-02 4.72 -4.410522822e-02 -4.410522822e-02 4.74 -4.047159091e-02 -4.047159091e-02 4.76 -3.713803617e-02 -3.713803617e-02 4.78 -3.407031750e-02 -3.407031750e-02 4.80 -3.123678817e-02 -3.123678817e-02 4.82 -2.860916622e-02 -2.860916622e-02 4.84 -2.616301165e-02 -2.616301165e-02 4.86 -2.387795331e-02 -2.387795331e-02 4.88 -2.173769428e-02 -2.173769428e-02 4.90 -1.972982000e-02 -1.972982000e-02 4.92 -1.784543119e-02 -1.784543119e-02 4.94 -1.607862733e-02 -1.607862733e-02 4.96 -1.442571623e-02 -1.442571623e-02 4.98 -1.288473900e-02 -1.288473900e-02 5.00 -1.145490639e-02 -1.145490639e-02 5.02 -1.013568444e-02 -1.013568444e-02 5.04 -8.926219524e-03 -8.926219524e-03 5.06 -7.824905552e-03 -7.824905552e-03 5.08 -6.829114677e-03 -6.829114677e-03 5.10 -5.935091532e-03 -5.935091532e-03 5.12 -5.137991375e-03 -5.137991375e-03 5.14 -4.432029028e-03 -4.432029028e-03 5.16 -3.810699240e-03 -3.810699240e-03 5.18 -3.267029881e-03 -3.267029881e-03 5.20 -2.793835325e-03 -2.793835325e-03 5.22 -2.383946120e-03 -2.383946120e-03 5.24 -2.030400324e-03 -2.030400324e-03 5.26 -1.726590179e-03 -1.726590179e-03 5.28 -1.466364115e-03 -1.466364115e-03 5.30 -1.244088341e-03 -1.244088341e-03 5.32 -1.054674524e-03 -1.054674524e-03 5.34 -8.935809232e-04 -8.935809232e-04 5.36 -7.567940543e-04 -7.567940543e-04 5.38 -6.407971877e-04 -6.407971877e-04 5.40 -5.425308514e-04 -5.425308514e-04 5.42 -4.593493844e-04 -4.593493844e-04 5.44 -3.889765207e-04 -3.889765207e-04 5.46 -3.294620816e-04 -3.294620816e-04 5.48 -2.791411260e-04 -2.791411260e-04 5.50 -2.365963508e-04 -2.365963508e-04 5.52 -2.006241207e-04 -2.006241207e-04 5.54 -1.702042207e-04 -1.702042207e-04 5.56 -1.444732325e-04 -1.444732325e-04 5.58 -1.227013147e-04 -1.227013147e-04 5.60 -1.042721040e-04 -1.042721040e-04 5.62 -8.866542192e-05 -8.866542192e-05 5.64 -7.544246946e-05 -7.544246946e-05 5.66 -6.423320125e-05 -6.423320125e-05 5.68 -5.472559456e-05 -5.472559456e-05 5.70 -4.665655207e-05 -4.665655207e-05 5.72 -3.980420619e-05 -3.980420619e-05 5.74 -3.398141983e-05 -3.398141983e-05 5.76 -2.903030477e-05 -2.903030477e-05 5.78 -2.481760305e-05 -2.481760305e-05 5.80 -2.123079841e-05 -2.123079841e-05 5.82 -1.817484399e-05 -1.817484399e-05 5.84 -1.556940971e-05 -1.556940971e-05 5.86 -1.334656706e-05 -1.334656706e-05 5.88 -1.144884198e-05 -1.144884198e-05 5.90 -9.827577215e-06 -9.827577215e-06 5.92 -8.441554626e-06 -8.441554626e-06 5.94 -7.255835964e-06 -7.255835964e-06 5.96 -6.240787161e-06 -6.240787161e-06 5.98 -5.371256750e-06 -5.371256750e-06 6.00 -4.625883774e-06 -4.625883774e-06