# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2017--Tehranchi-A-Curtin-W-A--Ni-H # implementation = EAM_Dynamo_TehranchiCurtin_2010_NiH__MO_535504325462_003 # composition = H3Ni # 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 2024-11-27 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 2.015783006e+01 nan nan 1.12 1.647696340e+01 nan nan 1.14 1.336880344e+01 nan nan 1.16 1.074422996e+01 nan nan 1.18 8.521959448e+00 nan nan 1.20 6.643659521e+00 nan nan 1.22 5.060672980e+00 1.688517254e+01 nan 1.24 3.727775192e+00 1.399152423e+01 1.910458974e+01 1.26 2.608601083e+00 1.150447016e+01 1.599179346e+01 1.28 1.674410707e+00 9.358163472e+00 1.332122762e+01 1.30 8.967441950e-01 7.504052412e+00 1.103482600e+01 1.32 2.496298862e-01 5.907238423e+00 9.077566707e+00 1.34 -2.895750900e-01 4.539765604e+00 7.392720029e+00 1.36 -7.380552277e-01 3.376362138e+00 5.933161269e+00 1.38 -1.109399455e+00 2.392432575e+00 4.668353988e+00 1.40 -1.414519754e+00 1.559418122e+00 3.575610022e+00 1.42 -1.663562177e+00 8.483951062e-01 2.634509617e+00 1.44 -1.866602845e+00 2.398210352e-01 1.824590143e+00 1.46 -2.030765161e+00 -2.789961974e-01 1.125272139e+00 1.48 -2.160928463e+00 -7.180085123e-01 5.202387186e-01 1.50 -2.262286794e+00 -1.085995631e+00 -1.016687693e-03 1.52 -2.339431011e+00 -1.391290163e+00 -4.461603051e-01 1.54 -2.396228544e+00 -1.641449247e+00 -8.224567085e-01 1.56 -2.435862985e+00 -1.843696800e+00 -1.138659124e+00 1.58 -2.460948247e+00 -2.005426510e+00 -1.403050772e+00 1.60 -2.473533353e+00 -2.133642802e+00 -1.623095187e+00 1.62 -2.474926027e+00 -2.234755698e+00 -1.805929817e+00 1.64 -2.466796628e+00 -2.314087614e+00 -1.957636608e+00 1.66 -2.453183191e+00 -2.376196258e+00 -2.083173822e+00 1.68 -2.437740707e+00 -2.424466653e+00 -2.186318755e+00 1.70 -2.421059397e+00 -2.460324226e+00 -2.270039656e+00 1.72 -2.402955804e+00 -2.484160705e+00 -2.336752455e+00 1.74 -2.383643215e+00 -2.496907857e+00 -2.388673414e+00 1.76 -2.363308069e+00 -2.499371701e+00 -2.427594874e+00 1.78 -2.342262477e+00 -2.492281420e+00 -2.454700398e+00 1.80 -2.321149521e+00 -2.477669052e+00 -2.470680390e+00 1.82 -2.300288193e+00 -2.458822164e+00 -2.476224892e+00 1.84 -2.279668308e+00 -2.437221595e+00 -2.472174369e+00 1.86 -2.259163640e+00 -2.413620736e+00 -2.460551414e+00 1.88 -2.238531697e+00 -2.388781773e+00 -2.445027435e+00 1.90 -2.217430885e+00 -2.363275199e+00 -2.427493376e+00 1.92 -2.195522863e+00 -2.337744616e+00 -2.408894455e+00 1.94 -2.172827587e+00 -2.312708518e+00 -2.389833549e+00 1.96 -2.150046882e+00 -2.288462397e+00 -2.370427848e+00 1.98 -2.127689050e+00 -2.265231818e+00 -2.350570130e+00 2.00 -2.105714896e+00 -2.243183332e+00 -2.330352143e+00 2.02 -2.084020819e+00 -2.222404615e+00 -2.309933785e+00 2.04 -2.062494239e+00 -2.202862415e+00 -2.289398583e+00 2.06 -2.041023288e+00 -2.184318971e+00 -2.268738032e+00 2.08 -2.019577764e+00 -2.166306141e+00 -2.247850187e+00 2.10 -1.998349441e+00 -2.148415313e+00 -2.226528899e+00 2.12 -1.977588014e+00 -2.130793860e+00 -2.204513838e+00 2.14 -1.957413964e+00 -2.113979161e+00 -2.181669546e+00 2.16 -1.937953315e+00 -2.098137582e+00 -2.158208636e+00 2.18 -1.919374579e+00 -2.083138890e+00 -2.134698701e+00 2.20 -1.901870427e+00 -2.068790019e+00 -2.111839542e+00 2.22 -1.885593387e+00 -2.054851212e+00 -2.089914871e+00 2.24 -1.870580763e+00 -2.041064205e+00 -2.069011540e+00 2.26 -1.856729913e+00 -2.027199211e+00 -2.049226482e+00 2.28 -1.843836314e+00 -2.013116727e+00 -2.030680348e+00 2.30 -1.831613458e+00 -1.998797841e+00 -2.013514306e+00 2.32 -1.819733320e+00 -1.984296810e+00 -1.997869370e+00 2.34 -1.807901560e+00 -1.969694245e+00 -1.983851671e+00 2.36 -1.795914213e+00 -1.955072481e+00 -1.971458992e+00 2.38 -1.783611711e+00 -1.940500798e+00 -1.960481041e+00 2.40 -1.770787252e+00 -1.926059844e+00 -1.950473536e+00 2.42 -1.757245199e+00 -1.911832692e+00 -1.940976505e+00 2.44 -1.742935252e+00 -1.897855959e+00 -1.931822569e+00 2.46 -1.727887753e+00 -1.884125961e+00 -1.922995809e+00 2.48 -1.712148990e+00 -1.870621751e+00 -1.914467820e+00 2.50 -1.695766556e+00 -1.857350248e+00 -1.906178897e+00 2.52 -1.678642066e+00 -1.844334130e+00 -1.898024954e+00 2.54 -1.661014462e+00 -1.831504732e+00 -1.889851871e+00 2.56 -1.643998926e+00 -1.818707374e+00 -1.881456684e+00 2.58 -1.627127918e+00 -1.805751956e+00 -1.872609036e+00 2.60 -1.607662065e+00 -1.792454065e+00 -1.863092411e+00 2.62 -1.584426656e+00 -1.778675527e+00 -1.852771809e+00 2.64 -1.558899319e+00 -1.764356089e+00 -1.841634607e+00 2.66 -1.533533219e+00 -1.749504115e+00 -1.829773718e+00 2.68 -1.509581492e+00 -1.734161816e+00 -1.817325945e+00 2.70 -1.487441576e+00 -1.718374288e+00 -1.804422226e+00 2.72 -1.467000967e+00 -1.701988062e+00 -1.791152548e+00 2.74 -1.447847155e+00 -1.685459817e+00 -1.777548174e+00 2.76 -1.429382853e+00 -1.670181866e+00 -1.763606811e+00 2.78 -1.410966370e+00 -1.653432635e+00 -1.749325232e+00 2.80 -1.392194239e+00 -1.632059504e+00 -1.734698768e+00 2.82 -1.372984412e+00 -1.607183499e+00 -1.719726145e+00 2.84 -1.353346671e+00 -1.582581609e+00 -1.704410822e+00 2.86 -1.333294404e+00 -1.560107397e+00 -1.688755259e+00 2.88 -1.312841369e+00 -1.540106709e+00 -1.672761620e+00 2.90 -1.292001771e+00 -1.522158630e+00 -1.656430683e+00 2.92 -1.270790326e+00 -1.505512936e+00 -1.639765252e+00 2.94 -1.249222127e+00 -1.489316373e+00 -1.622765352e+00 2.96 -1.227312814e+00 -1.472893215e+00 -1.605432444e+00 2.98 -1.205078396e+00 -1.455991758e+00 -1.587768220e+00 3.00 -1.182535421e+00 -1.438598662e+00 -1.569769855e+00 3.02 -1.159701088e+00 -1.420727015e+00 -1.551446872e+00 3.04 -1.136592762e+00 -1.402390501e+00 -1.532656697e+00 3.06 -1.113228438e+00 -1.383603147e+00 -1.513492118e+00 3.08 -1.089626347e+00 -1.364379366e+00 -1.494342802e+00 3.10 -1.065805218e+00 -1.344733997e+00 -1.475556080e+00 3.12 -1.041784316e+00 -1.324682357e+00 -1.456762489e+00 3.14 -1.017582971e+00 -1.304240031e+00 -1.436838649e+00 3.16 -9.932209708e-01 -1.283423041e+00 -1.415107222e+00 3.18 -9.687181263e-01 -1.262247818e+00 -1.391309706e+00 3.20 -9.440947785e-01 -1.240731242e+00 -1.365969427e+00 3.22 -9.193711104e-01 -1.218890606e+00 -1.340117490e+00 3.24 -8.945676986e-01 -1.196743498e+00 -1.314471876e+00 3.26 -8.697050218e-01 -1.174307951e+00 -1.289465665e+00 3.28 -8.448036831e-01 -1.151602302e+00 -1.265314298e+00 3.30 -8.198844352e-01 -1.128645208e+00 -1.242075772e+00 3.32 -7.949675016e-01 -1.105455624e+00 -1.219698959e+00 3.34 -7.700737082e-01 -1.082052765e+00 -1.198055321e+00 3.36 -7.452230195e-01 -1.058456250e+00 -1.176952190e+00 3.38 -7.204358391e-01 -1.034685767e+00 -1.156143971e+00 3.40 -6.957323081e-01 -1.010761368e+00 -1.135375435e+00 3.42 -6.711317829e-01 -9.867030990e-01 -1.114471758e+00 3.44 -6.466543128e-01 -9.625314602e-01 -1.093382912e+00 3.46 -6.223189692e-01 -9.382668171e-01 -1.072116506e+00 3.48 -5.981444737e-01 -9.139300818e-01 -1.050686129e+00 3.50 -5.741502397e-01 -8.895420610e-01 -1.029105729e+00 3.52 -5.503543810e-01 -8.651237292e-01 -1.007389170e+00 3.54 -5.267746472e-01 -8.406965426e-01 -9.855507872e-01 3.56 -5.034296394e-01 -8.162814335e-01 -9.636047244e-01 3.58 -4.803371471e-01 -7.919005761e-01 -9.415656885e-01 3.60 -4.575135296e-01 -7.675753636e-01 -9.194480270e-01 3.62 -4.349765538e-01 -7.433279119e-01 -8.972665229e-01 3.64 -4.127445598e-01 -7.191813339e-01 -8.750358545e-01 3.66 -3.908331593e-01 -6.951576599e-01 -8.527706378e-01 3.68 -3.692586726e-01 -6.712805043e-01 -8.304859153e-01 3.70 -3.480394077e-01 -6.475747411e-01 -8.081960825e-01 3.72 -3.271945459e-01 -6.240636390e-01 -7.859159225e-01 3.74 -3.067384320e-01 -6.007718405e-01 -7.636601679e-01 3.76 -2.866859276e-01 -5.777288854e-01 -7.414430198e-01 3.78 -2.670602055e-01 -5.549659752e-01 -7.192792073e-01 3.80 -2.478853021e-01 -5.325215122e-01 -6.971830496e-01 3.82 -2.291862073e-01 -5.104177048e-01 -6.751683571e-01 3.84 -2.109998251e-01 -4.886704301e-01 -6.532494699e-01 3.86 -1.933466475e-01 -4.673040387e-01 -6.314403265e-01 3.88 -1.762235983e-01 -4.463502269e-01 -6.097541318e-01 3.90 -1.596375016e-01 -4.258174773e-01 -5.882046355e-01 3.92 -1.436046370e-01 -4.057600470e-01 -5.668056247e-01 3.94 -1.281501487e-01 -3.862742893e-01 -5.455695599e-01 3.96 -1.132947523e-01 -3.674350695e-01 -5.245093551e-01 3.98 -9.900547821e-02 -3.492982136e-01 -5.036383857e-01 4.00 -8.539598668e-02 -3.319014402e-01 -4.829693549e-01 4.02 -7.258937875e-02 -3.152646932e-01 -4.625138246e-01 4.04 -6.068749139e-02 -2.993909595e-01 -4.422844201e-01 4.06 -4.977348658e-02 -2.842637755e-01 -4.222942124e-01 4.08 -3.991378627e-02 -2.698432894e-01 -4.025556048e-01 4.10 -3.115917577e-02 -2.560624238e-01 -3.830790510e-01 4.12 -2.354481702e-02 -2.428297804e-01 -3.638771704e-01 4.14 -1.708883063e-02 -2.300364245e-01 -3.449632584e-01 4.16 -1.178906521e-02 -2.175753620e-01 -3.263511614e-01 4.18 -7.617773401e-03 -2.053671724e-01 -3.080503210e-01 4.20 -4.514348401e-03 -1.933807775e-01 -2.900711653e-01 4.22 -2.377337051e-03 -1.816201462e-01 -2.724302193e-01 4.24 -1.058892439e-03 -1.700963596e-01 -2.551445394e-01 4.26 -3.673979471e-04 -1.588211802e-01 -2.382317704e-01 4.28 -8.569767906e-05 -1.478078817e-01 -2.217118225e-01 4.30 -1.005933698e-05 -1.370769544e-01 -2.056154316e-01 4.32 -3.074120029e-07 -1.266293077e-01 -1.899439616e-01 4.34 -3.998253673e-10 -1.164646076e-01 -1.746969114e-01 4.36 -4.078955033e-14 -1.065867832e-01 -1.598801748e-01 4.38 -3.469694552e-29 -9.700377263e-02 -1.455056589e-01 4.40 0.000000000e+00 -8.772729882e-02 -1.315909482e-01 4.42 0.000000000e+00 -7.877231913e-02 -1.181584787e-01 4.44 0.000000000e+00 -7.011779382e-02 -1.051766907e-01 4.46 0.000000000e+00 -6.179336816e-02 -9.269005224e-02 4.48 0.000000000e+00 -5.386322508e-02 -8.079483762e-02 4.50 0.000000000e+00 -4.638178310e-02 -6.957267465e-02 4.52 0.000000000e+00 -3.939481317e-02 -5.909221975e-02 4.54 0.000000000e+00 -3.294035930e-02 -4.941053895e-02 4.56 0.000000000e+00 -2.704942501e-02 -4.057413752e-02 4.58 0.000000000e+00 -2.174636654e-02 -3.261954982e-02 4.60 0.000000000e+00 -1.704891165e-02 -2.557336748e-02 4.62 0.000000000e+00 -1.296770046e-02 -1.945155070e-02 4.64 0.000000000e+00 -9.505228118e-03 -1.425784218e-02 4.66 0.000000000e+00 -6.654088323e-03 -9.981132484e-03 4.68 0.000000000e+00 -4.394490987e-03 -6.591736481e-03 4.70 0.000000000e+00 -2.691242807e-03 -4.036864211e-03 4.72 0.000000000e+00 -1.490774038e-03 -2.236161057e-03 4.74 0.000000000e+00 -7.194405202e-04 -1.079160780e-03 4.76 0.000000000e+00 -2.850447719e-04 -4.275671579e-04 4.78 0.000000000e+00 -8.393258997e-05 -1.258988850e-04 4.80 0.000000000e+00 -1.535386881e-05 -2.303080322e-05 4.82 0.000000000e+00 -1.220359143e-06 -1.830538714e-06 4.84 0.000000000e+00 -1.835531776e-08 -2.753297665e-08 4.86 0.000000000e+00 -2.664596475e-12 -3.996894712e-12 4.88 0.000000000e+00 -4.318472751e-16 -6.477709126e-16 4.90 0.000000000e+00 -9.306409750e-31 -1.395961463e-30 4.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 4.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.00 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.02 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.04 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.06 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.08 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.10 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.12 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.14 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.16 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.18 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.20 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.22 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.24 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.26 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.28 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.30 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.32 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.34 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.36 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.38 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.40 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.42 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.44 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.46 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.48 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.50 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.52 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.54 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.56 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.58 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.60 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.62 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.64 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.66 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.68 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.70 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.72 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.74 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.76 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.78 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.80 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.82 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.84 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.86 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.88 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.90 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.92 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.94 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.96 0.000000000e+00 0.000000000e+00 0.000000000e+00 5.98 0.000000000e+00 0.000000000e+00 0.000000000e+00 6.00 0.000000000e+00 0.000000000e+00 0.000000000e+00