# 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 = CoMg3 # 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 3.574395256e+02 nan nan 1.16 3.279958782e+02 nan nan 1.18 3.010468397e+02 nan nan 1.20 2.763661076e+02 nan nan 1.22 2.537499284e+02 nan nan 1.24 2.330148545e+02 nan nan 1.26 2.139956214e+02 nan nan 1.28 1.965426309e+02 3.079859393e+02 3.544123340e+02 1.30 1.805201577e+02 2.846370532e+02 3.281603268e+02 1.32 1.658053829e+02 2.630943246e+02 3.039048644e+02 1.34 1.522872229e+02 2.432089584e+02 2.814843082e+02 1.36 1.398647219e+02 2.248459777e+02 2.607513733e+02 1.38 1.284456638e+02 2.078829986e+02 2.415710602e+02 1.40 1.179459042e+02 1.922086244e+02 2.238195190e+02 1.42 1.082889603e+02 1.777207502e+02 2.073836899e+02 1.44 9.940589175e+01 1.643251634e+02 1.921607146e+02 1.46 9.123314959e+01 1.519348661e+02 1.780567729e+02 1.48 8.371199644e+01 1.404700888e+02 1.649858778e+02 1.50 7.678885248e+01 1.298583105e+02 1.528690356e+02 1.52 7.041471288e+01 1.200337197e+02 1.416336746e+02 1.54 6.454504692e+01 1.109362859e+02 1.312131742e+02 1.56 5.913948259e+01 1.025111278e+02 1.215464120e+02 1.58 5.416127777e+01 9.470832780e+01 1.125772552e+02 1.60 4.957676316e+01 8.748085613e+01 1.042540857e+02 1.62 4.535491307e+01 8.078576391e+01 9.652992006e+01 1.64 4.146710791e+01 7.458330052e+01 8.936031954e+01 1.66 3.788701876e+01 6.883652457e+01 8.270432642e+01 1.68 3.459048910e+01 6.351118325e+01 7.652425891e+01 1.70 3.155534785e+01 5.857571326e+01 7.078544520e+01 1.72 2.876117769e+01 5.400116084e+01 6.545603646e+01 1.74 2.618912576e+01 4.976095742e+01 6.050668689e+01 1.76 2.382178277e+01 4.583063695e+01 5.591024205e+01 1.78 2.164310254e+01 4.218761588e+01 5.164152376e+01 1.80 1.963830440e+01 3.881103770e+01 4.767720791e+01 1.82 1.779373044e+01 3.568163866e+01 4.399568201e+01 1.84 1.609670466e+01 3.278158867e+01 4.057686360e+01 1.86 1.453546055e+01 3.009435882e+01 3.740200035e+01 1.88 1.309915454e+01 2.760460831e+01 3.445354702e+01 1.90 1.177790044e+01 2.529808690e+01 3.171514868e+01 1.92 1.056274786e+01 2.316153235e+01 2.917167650e+01 1.94 9.445588169e+00 2.118258221e+01 2.680924643e+01 1.96 8.419023636e+00 1.934971641e+01 2.461514064e+01 1.98 7.476250752e+00 1.765224148e+01 2.257766204e+01 2.00 6.610975176e+00 1.608028568e+01 2.068598138e+01 2.02 5.817350143e+00 1.462477398e+01 1.893002193e+01 2.04 5.089937347e+00 1.327737106e+01 1.730039489e+01 2.06 4.423674800e+00 1.203039670e+01 1.578836006e+01 2.08 3.813853434e+00 1.087673304e+01 1.438579526e+01 2.10 3.256095503e+00 9.809748940e+00 1.308515133e+01 2.12 2.746329014e+00 8.823251515e+00 1.187940553e+01 2.14 2.280756326e+00 7.911460780e+00 1.076201583e+01 2.16 1.855781720e+00 7.068998829e+00 9.726877259e+00 2.18 1.468142359e+00 6.290876008e+00 8.768278681e+00 2.20 1.114843050e+00 5.572472015e+00 7.880857330e+00 2.22 7.931257048e-01 4.909506392e+00 7.059577629e+00 2.24 5.004698199e-01 4.298010697e+00 6.299719539e+00 2.26 2.345765809e-01 3.734305830e+00 5.596889761e+00 2.28 -6.658752955e-03 3.214982192e+00 4.947028236e+00 2.30 -2.251420053e-01 2.736887439e+00 4.346402251e+00 2.32 -4.225674487e-01 2.297102322e+00 3.791574686e+00 2.34 -6.005145116e-01 1.892906406e+00 3.279363234e+00 2.36 -7.604634731e-01 1.521757350e+00 2.806800368e+00 2.38 -9.037962307e-01 1.181363613e+00 2.371101542e+00 2.40 -1.031799175e+00 8.695765414e-01 1.969647754e+00 2.42 -1.145668372e+00 5.843689654e-01 1.599940627e+00 2.44 -1.246517619e+00 3.238251253e-01 1.259720471e+00 2.46 -1.335386992e+00 8.613172910e-02 9.469029747e-01 2.48 -1.413249434e+00 -1.304254045e-01 6.595462169e-01 2.50 -1.481013964e+00 -3.274457816e-01 3.958421066e-01 2.52 -1.539525912e+00 -5.063713776e-01 1.541114901e-01 2.54 -1.589565781e+00 -6.685482721e-01 -6.720477136e-02 2.56 -1.631851738e+00 -8.152454291e-01 -2.695498730e-01 2.58 -1.667039856e+00 -9.476555189e-01 -4.542184095e-01 2.60 -1.695732335e+00 -1.066894645e+00 -6.223782827e-01 2.62 -1.718483228e+00 -1.173999068e+00 -7.751236927e-01 2.64 -1.735806772e+00 -1.269923338e+00 -9.134828514e-01 2.66 -1.748183177e+00 -1.355535599e+00 -1.038418386e+00 2.68 -1.756065579e+00 -1.431623727e+00 -1.150834498e+00 2.70 -1.759884886e+00 -1.498903544e+00 -1.251581547e+00 2.72 -1.760053124e+00 -1.558030179e+00 -1.341462056e+00 2.74 -1.756964501e+00 -1.609608742e+00 -1.421237312e+00 2.76 -1.750994023e+00 -1.654202298e+00 -1.491634286e+00 2.78 -1.742494099e+00 -1.692336493e+00 -1.553352279e+00 2.80 -1.731827393e+00 -1.724503781e+00 -1.607068800e+00 2.82 -1.719314844e+00 -1.751162714e+00 -1.653441877e+00 2.84 -1.705149419e+00 -1.772741196e+00 -1.693109426e+00 2.86 -1.689513475e+00 -1.789637808e+00 -1.726683509e+00 2.88 -1.672580100e+00 -1.802224043e+00 -1.754741115e+00 2.90 -1.654508577e+00 -1.810846967e+00 -1.777813862e+00 2.92 -1.635443274e+00 -1.815832258e+00 -1.796379935e+00 2.94 -1.615510132e+00 -1.817487536e+00 -1.810860913e+00 2.96 -1.594749506e+00 -1.816105785e+00 -1.821623329e+00 2.98 -1.573134155e+00 -1.811968470e+00 -1.828989685e+00 3.00 -1.550654490e+00 -1.805347759e+00 -1.833241217e+00 3.02 -1.527319670e+00 -1.796507167e+00 -1.834631679e+00 3.04 -1.503155234e+00 -1.785708596e+00 -1.833393663e+00 3.06 -1.478200803e+00 -1.773243246e+00 -1.829744134e+00 3.08 -1.452507722e+00 -1.759293338e+00 -1.823888021e+00 3.10 -1.426136674e+00 -1.744007414e+00 -1.816020278e+00 3.12 -1.399155309e+00 -1.727522070e+00 -1.806328480e+00 3.14 -1.371635941e+00 -1.709962046e+00 -1.795041824e+00 3.16 -1.343653292e+00 -1.691437710e+00 -1.782305097e+00 3.18 -1.315282368e+00 -1.672049626e+00 -1.768224541e+00 3.20 -1.286596538e+00 -1.651888704e+00 -1.752907075e+00 3.22 -1.257666065e+00 -1.630993255e+00 -1.736458234e+00 3.24 -1.228557244e+00 -1.609346774e+00 -1.718979221e+00 3.26 -1.199332318e+00 -1.586950631e+00 -1.700566371e+00 3.28 -1.170050119e+00 -1.563827215e+00 -1.681310440e+00 3.30 -1.140767237e+00 -1.540016407e+00 -1.661280635e+00 3.32 -1.111539377e+00 -1.515571411e+00 -1.640473953e+00 3.34 -1.082422261e+00 -1.490554228e+00 -1.618880572e+00 3.36 -1.053473222e+00 -1.465031230e+00 -1.596506812e+00 3.38 -1.024749277e+00 -1.439069396e+00 -1.573372522e+00 3.40 -9.963072098e-01 -1.412733493e+00 -1.549509155e+00 3.42 -9.682012814e-01 -1.386085094e+00 -1.524958210e+00 3.44 -9.404825106e-01 -1.359181251e+00 -1.499769906e+00 3.46 -9.131952285e-01 -1.332075283e+00 -1.474001925e+00 3.48 -8.863773908e-01 -1.304817116e+00 -1.447718088e+00 3.50 -8.600596011e-01 -1.277453808e+00 -1.420986186e+00 3.52 -8.342666357e-01 -1.250029935e+00 -1.393879073e+00 3.54 -8.090160519e-01 -1.222587799e+00 -1.366468490e+00 3.56 -7.843204040e-01 -1.195167471e+00 -1.338826596e+00 3.58 -7.601876627e-01 -1.167806737e+00 -1.311023852e+00 3.60 -7.366219798e-01 -1.140541009e+00 -1.283128158e+00 3.62 -7.136243904e-01 -1.113403257e+00 -1.255204350e+00 3.64 -6.911934449e-01 -1.086424001e+00 -1.227313807e+00 3.66 -6.693257573e-01 -1.059631406e+00 -1.199513995e+00 3.68 -6.480164601e-01 -1.033051468e+00 -1.171857810e+00 3.70 -6.272595602e-01 -1.006708319e+00 -1.144392814e+00 3.72 -6.070482000e-01 -9.806246089e-01 -1.117160547e+00 3.74 -5.873748402e-01 -9.548219593e-01 -1.090196172e+00 3.76 -5.682313827e-01 -9.293214258e-01 -1.063528583e+00 3.78 -5.496092543e-01 -9.041439231e-01 -1.037180991e+00 3.80 -5.314994677e-01 -8.793105344e-01 -1.011171859e+00 3.82 -5.138926709e-01 -8.548426321e-01 -9.855159817e-01 3.84 -4.967791921e-01 -8.307617444e-01 -9.602255231e-01 3.86 -4.801490790e-01 -8.070891372e-01 -9.353108754e-01 3.88 -4.639921324e-01 -7.838451284e-01 -9.107812773e-01 3.90 -4.482979289e-01 -7.610482207e-01 -8.866451930e-01 3.92 -4.330555707e-01 -7.387138980e-01 -8.629100785e-01 3.94 -4.182547675e-01 -7.168550470e-01 -8.395841647e-01 3.96 -4.038840850e-01 -6.954794868e-01 -8.166736507e-01 3.98 -3.899321287e-01 -6.745911408e-01 -7.941845663e-01 4.00 -3.763871673e-01 -6.541898339e-01 -7.721221557e-01 4.02 -3.632370798e-01 -6.342717568e-01 -7.504907916e-01 4.04 -3.504693055e-01 -6.148301376e-01 -7.292939123e-01 4.06 -3.380708047e-01 -5.958560194e-01 -7.085339818e-01 4.08 -3.260280381e-01 -5.773390578e-01 -6.882124745e-01 4.10 -3.143269723e-01 -5.592674100e-01 -6.683298807e-01 4.12 -3.029531209e-01 -5.416321056e-01 -6.488857300e-01 4.14 -2.918916287e-01 -5.244218669e-01 -6.298786302e-01 4.16 -2.811274112e-01 -5.076277543e-01 -6.113063172e-01 4.18 -2.706453576e-01 -4.912425312e-01 -5.931657167e-01 4.20 -2.604299402e-01 -4.752610115e-01 -5.754530157e-01 4.22 -2.504683862e-01 -4.596802603e-01 -5.581637440e-01 4.24 -2.407466865e-01 -4.444996068e-01 -5.412928653e-01 4.26 -2.312532584e-01 -4.297204287e-01 -5.248348787e-01 4.28 -2.219787036e-01 -4.153456935e-01 -5.087839307e-01 4.30 -2.129164265e-01 -4.013792725e-01 -4.931339326e-01 4.32 -2.040632184e-01 -3.878250921e-01 -4.778786835e-01 4.34 -1.954197264e-01 -3.746862229e-01 -4.630119866e-01 4.36 -1.869905822e-01 -3.619640297e-01 -4.485277520e-01 4.38 -1.787848909e-01 -3.496574983e-01 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-2.131862314e-02 -3.124592131e-02 5.82 -6.396032918e-03 -2.049569120e-02 -3.011605225e-02 5.84 -6.086133765e-03 -1.970160119e-02 -2.901524006e-02 5.86 -5.792552918e-03 -1.893398343e-02 -2.794167794e-02 5.88 -5.514225906e-03 -1.819060125e-02 -2.689359358e-02 5.90 -5.250047306e-03 -1.746935280e-02 -2.586925342e-02 5.92 -4.998896152e-03 -1.676827145e-02 -2.486696949e-02 5.94 -4.759659546e-03 -1.608552593e-02 -2.388510907e-02 5.96 -4.531253535e-03 -1.541942129e-02 -2.292210498e-02 5.98 -4.312640831e-03 -1.476840126e-02 -2.197645779e-02 6.00 -4.102845339e-03 -1.413105287e-02 -2.104678933e-02