# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2026--Tirumala-A-S-Shattock-O-Mason-D-R-et-al--W-H-He # implementation = 2026--Tirumala-A-S--W-H-He--LAMMPS--ipr1 # composition = HHe3 # 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 2026-06-16 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 4.930442085e+01 nan nan 0.82 4.024651606e+01 nan nan 0.84 3.311991403e+01 nan nan 0.86 2.752175907e+01 nan nan 0.88 2.311482820e+01 nan nan 0.90 1.962947503e+01 3.853895697e+01 5.124206014e+01 0.92 1.685913566e+01 3.217593583e+01 4.334789971e+01 0.94 1.463978604e+01 2.708046109e+01 3.673620919e+01 0.96 1.284972404e+01 2.300818035e+01 3.120565714e+01 0.98 1.139387286e+01 1.975709094e+01 2.658540717e+01 1.00 1.019630344e+01 1.715239885e+01 2.273782107e+01 1.02 9.199448837e+00 1.504690287e+01 1.954800481e+01 1.04 8.346277992e+00 1.332401134e+01 1.691142962e+01 1.06 7.590779187e+00 1.189368260e+01 1.473723630e+01 1.08 6.907451202e+00 1.069082477e+01 1.294887211e+01 1.10 6.282321952e+00 9.674931949e+00 1.148202573e+01 1.12 5.705451901e+00 8.814099632e+00 1.028175823e+01 1.14 5.170838359e+00 8.068066941e+00 9.297222665e+00 1.16 4.675420727e+00 7.405658991e+00 8.482625014e+00 1.18 4.218010127e+00 6.805894274e+00 7.785759117e+00 1.20 3.797966339e+00 6.254419549e+00 7.167102581e+00 1.22 3.414801749e+00 5.742201035e+00 6.603532433e+00 1.24 3.068215462e+00 5.263990478e+00 6.082354682e+00 1.26 2.757855829e+00 4.816871431e+00 5.596993729e+00 1.28 2.482767686e+00 4.399240502e+00 5.144265092e+00 1.30 2.240205028e+00 4.009972684e+00 4.722962059e+00 1.32 2.026748236e+00 3.647974239e+00 4.332488525e+00 1.34 1.839095296e+00 3.312300730e+00 3.971437278e+00 1.36 1.674184354e+00 3.002193315e+00 3.638571652e+00 1.38 1.529232632e+00 2.717023049e+00 3.332317286e+00 1.40 1.401713412e+00 2.456250882e+00 3.050875186e+00 1.42 1.289393843e+00 2.219375072e+00 2.792466669e+00 1.44 1.190322577e+00 2.005811781e+00 2.555310846e+00 1.46 1.102816075e+00 1.814820559e+00 2.337686903e+00 1.48 1.025318173e+00 1.645399703e+00 2.137966327e+00 1.50 9.565071203e-01 1.496411501e+00 1.954550208e+00 1.52 8.954284486e-01 1.366761089e+00 1.785991695e+00 1.54 8.415773571e-01 1.254870102e+00 1.631090064e+00 1.56 7.948436888e-01 1.158564737e+00 1.488877514e+00 1.58 7.559129478e-01 1.075823602e+00 1.358542178e+00 1.60 7.357247844e-01 1.004843032e+00 1.239401798e+00 1.62 7.306404100e-01 9.440495693e-01 1.130889665e+00 1.64 6.985693443e-01 8.920767720e-01 1.032489139e+00 1.66 6.650024391e-01 8.478562805e-01 9.437953620e-01 1.68 6.319145503e-01 8.108970765e-01 8.646165244e-01 1.70 5.998728669e-01 7.819790159e-01 7.944425145e-01 1.72 5.691218604e-01 7.807571231e-01 7.323327038e-01 1.74 5.398454087e-01 7.744736182e-01 6.774251484e-01 1.76 5.122847159e-01 7.467096796e-01 6.289691182e-01 1.78 4.867672986e-01 7.170390678e-01 5.863147139e-01 1.80 4.633205770e-01 6.873271874e-01 5.489089367e-01 1.82 4.417443547e-01 6.582443221e-01 5.162882374e-01 1.84 4.217811534e-01 6.301598540e-01 4.880736071e-01 1.86 4.031799959e-01 6.033851688e-01 4.638964002e-01 1.88 3.857177309e-01 5.782845172e-01 4.433752796e-01 1.90 3.691944786e-01 5.550582729e-01 4.262661710e-01 1.92 3.534394291e-01 5.335307496e-01 4.125776798e-01 1.94 3.383009020e-01 5.135152890e-01 4.030618269e-01 1.96 3.236518319e-01 4.948102718e-01 4.067018516e-01 1.98 3.093841704e-01 4.772157054e-01 4.216133460e-01 2.00 2.954081499e-01 4.605442834e-01 4.126947537e-01 2.02 2.816547228e-01 4.446017288e-01 4.019107777e-01 2.04 2.680691692e-01 4.292081988e-01 3.901362433e-01 2.06 2.546129066e-01 4.142083843e-01 3.780444752e-01 2.08 2.412607859e-01 3.994675101e-01 3.658880367e-01 2.10 2.279992096e-01 3.848728920e-01 3.538024596e-01 2.12 2.148227195e-01 3.703309067e-01 3.418805731e-01 2.14 2.017265853e-01 3.557628668e-01 3.302139787e-01 2.16 1.886874177e-01 3.411096727e-01 3.189174148e-01 2.18 1.756900949e-01 3.263321208e-01 3.081127358e-01 2.20 1.627298382e-01 3.114046162e-01 2.977584306e-01 2.22 1.498100576e-01 2.963210335e-01 2.877404388e-01 2.24 1.369440800e-01 2.810873759e-01 2.779527562e-01 2.26 1.241549858e-01 2.657234557e-01 2.683024720e-01 2.28 1.114738871e-01 2.502602642e-01 2.587077130e-01 2.30 9.893944413e-02 2.347368041e-01 2.490961700e-01 2.32 8.659987534e-02 2.192096238e-01 2.394113518e-01 2.34 7.450863008e-02 2.037422494e-01 2.296052950e-01 2.36 6.272427559e-02 1.884033457e-01 2.196442259e-01 2.38 5.130910565e-02 1.732655017e-01 2.095041158e-01 2.40 4.032657020e-02 1.584010273e-01 1.991703751e-01 2.42 2.984159010e-02 1.438861227e-01 1.886385468e-01 2.44 1.991618497e-02 1.297922199e-01 1.779151223e-01 2.46 1.060743283e-02 1.161798559e-01 1.670039518e-01 2.48 1.967853938e-03 1.031030266e-01 1.559250504e-01 2.50 -5.960052186e-03 9.060581200e-02 1.447074120e-01 2.52 -1.314277832e-02 7.872549864e-02 1.333867657e-01 2.54 -1.955780195e-02 6.747038646e-02 1.220026726e-01 2.56 -2.519399418e-02 5.682776507e-02 1.106009724e-01 2.58 -3.005430429e-02 4.677086516e-02 9.923094867e-02 2.60 -3.415401134e-02 3.727675615e-02 8.794714123e-02 2.62 -3.754156047e-02 2.832814499e-02 7.680571576e-02 2.64 -4.028997486e-02 1.991181063e-02 6.586660813e-02 2.66 -4.246790902e-02 1.201797173e-02 5.518863569e-02 2.68 -4.413508280e-02 4.641404538e-03 4.483368198e-02 2.70 -4.534525757e-02 -2.221426168e-03 3.486257450e-02 2.72 -4.615085334e-02 -8.571936061e-03 2.533132694e-02 2.74 -4.660383104e-02 -1.441030581e-02 1.629788666e-02 2.76 -4.674982201e-02 -1.973704259e-02 7.811870271e-03 2.78 -4.663042992e-02 -2.455226953e-02 -7.809691471e-05 2.80 -4.628314487e-02 -2.885943233e-02 -7.332085920e-03 2.82 -4.573957216e-02 -3.266312255e-02 -1.391842439e-02 2.84 -4.502929153e-02 -3.597050261e-02 -1.982558361e-02 2.86 -4.417688084e-02 -3.879255712e-02 -2.505588882e-02 2.88 -4.320484216e-02 -4.114300555e-02 -2.961738824e-02 2.90 -4.213203311e-02 -4.304071618e-02 -3.352885254e-02 2.92 -4.097536971e-02 -4.451302810e-02 -3.682307109e-02 2.94 -3.974955827e-02 -4.560252746e-02 -3.955697295e-02 2.96 -3.846671971e-02 -4.634872005e-02 -4.178570758e-02 2.98 -3.713774051e-02 -4.678843332e-02 -4.356114538e-02 3.00 -3.577126433e-02 -4.695535337e-02 -4.493067332e-02 3.02 -3.437572939e-02 -4.688119980e-02 -4.593781735e-02 3.04 -3.295796973e-02 -4.659465930e-02 -4.662273935e-02 3.06 -3.152282289e-02 -4.612191663e-02 -4.702192483e-02 3.08 -3.007568487e-02 -4.548670911e-02 -4.716846389e-02 3.10 -2.861984729e-02 -4.471012977e-02 -4.709269637e-02 3.12 -2.715936460e-02 -4.381170693e-02 -4.682227626e-02 3.14 -2.569680842e-02 -4.280849332e-02 -4.638192990e-02 3.16 -2.423448618e-02 -4.171593642e-02 -4.579362209e-02 3.18 -2.277206142e-02 -4.054794795e-02 -4.507782227e-02 3.20 -2.130594287e-02 -3.931713920e-02 -4.425256517e-02 3.22 -1.984159037e-02 -3.803475879e-02 -4.333457910e-02 3.24 -1.838543893e-02 -3.671061001e-02 -4.233868291e-02 3.26 -1.694345485e-02 -3.535388953e-02 -4.127778069e-02 3.28 -1.552231729e-02 -3.397184423e-02 -4.016305672e-02 3.30 -1.412909106e-02 -3.257127584e-02 -3.900416925e-02 3.32 -1.276933776e-02 -3.115708680e-02 -3.780888290e-02 3.34 -1.145050238e-02 -2.973457715e-02 -3.658462797e-02 3.36 -1.017884030e-02 -2.830764269e-02 -3.533750362e-02 3.38 -8.960957207e-03 -2.688003506e-02 -3.407233331e-02 3.40 -7.802856174e-03 -2.545470461e-02 -3.279349450e-02 3.42 -6.710266582e-03 -2.403445940e-02 -3.150509343e-02 3.44 -5.689499461e-03 -2.261595024e-02 -3.020926160e-02 3.46 -4.744076538e-03 -2.119924800e-02 -2.890877326e-02 3.48 -3.880205705e-03 -1.979124442e-02 -2.760671987e-02 3.50 -3.099766177e-03 -1.839852998e-02 -2.630473877e-02 3.52 -2.407091368e-03 -1.702703855e-02 -2.500419141e-02 3.54 -1.803363100e-03 -1.568361527e-02 -2.370701341e-02 3.56 -1.281745683e-03 -1.437419626e-02 -2.241028076e-02 3.58 -8.366523119e-04 -1.310442210e-02 -2.111321517e-02 3.60 -4.604766269e-04 -1.187953554e-02 -1.981941241e-02 3.62 -1.482083505e-04 -1.070497180e-02 -1.853361234e-02 3.64 1.071849132e-04 -9.584652472e-03 -1.725908793e-02 3.66 3.111848324e-04 -8.523343436e-03 -1.600144840e-02 3.68 4.690260933e-04 -7.524583976e-03 -1.476467850e-02 3.70 5.877640558e-04 -6.590708161e-03 -1.355293734e-02 3.72 6.705556350e-04 -5.724896065e-03 -1.237106536e-02 3.74 7.229713487e-04 -4.928403898e-03 -1.122374064e-02 3.76 7.490324450e-04 -4.203076997e-03 -1.011548625e-02 3.78 7.536069693e-04 -3.548989199e-03 -9.050307486e-03 3.80 7.384751846e-04 -2.965966282e-03 -8.032472223e-03 3.82 7.094503431e-04 -2.453173825e-03 -7.066897973e-03 3.84 6.681383182e-04 -2.001655991e-03 -6.156013884e-03 3.86 6.173711779e-04 -1.607875118e-03 -5.304795585e-03 3.88 5.602576462e-04 -1.264511544e-03 -4.514712039e-03 3.90 4.984234724e-04 -9.674047170e-04 -3.789902933e-03 3.92 4.339634081e-04 -7.116310542e-04 -3.131762826e-03 3.94 3.685005957e-04 -4.931656644e-04 -2.542692517e-03 3.96 3.053325229e-04 -3.068275754e-04 -2.022515184e-03 3.98 2.429487244e-04 -1.506417667e-04 -1.566147334e-03 4.00 1.859713219e-04 -1.981537941e-05 -1.168688060e-03 4.02 1.306256618e-04 8.859471723e-05 -8.253076107e-04 4.04 8.162796270e-05 1.771641335e-04 -5.320255195e-04 4.06 3.589986582e-05 2.492177470e-04 -2.830978061e-04 4.08 -4.254881989e-06 3.056138109e-04 -7.586159944e-05 4.10 -3.803610933e-05 3.504735210e-04 9.555508337e-05 4.12 -6.749472872e-05 3.836961232e-04 2.339425184e-04 4.14 -9.207277463e-05 4.072485988e-04 3.434358417e-04 4.16 -1.114767474e-04 4.214969030e-04 4.261848905e-04 4.18 -1.256600635e-04 4.300735175e-04 4.876962772e-04 4.20 -1.354605250e-04 4.307556792e-04 5.289396823e-04 4.22 -1.407832511e-04 4.269679388e-04 5.549314749e-04 4.24 -1.421531176e-04 4.175788344e-04 5.658142065e-04 4.26 -1.391266892e-04 4.046999591e-04 5.657956820e-04 4.28 -1.343450494e-04 3.885827076e-04 5.562561845e-04 4.30 -1.275011144e-04 3.703187518e-04 5.396875006e-04 4.32 -1.186594744e-04 3.491641339e-04 5.157486923e-04 4.34 -1.085109257e-04 3.278582397e-04 4.891606599e-04 4.36 -9.918155703e-05 3.043974472e-04 4.574952594e-04 4.38 -9.018702111e-05 2.810944617e-04 4.246612039e-04 4.40 -8.154822896e-05 2.567641347e-04 3.892655986e-04 4.42 -7.328859990e-05 2.339432706e-04 3.554130008e-04 4.44 -6.542582869e-05 2.105432392e-04 3.202145549e-04 4.46 -5.797921323e-05 1.877450886e-04 2.856255721e-04 4.48 -5.096733137e-05 1.662565280e-04 2.528472666e-04 4.50 -4.440221524e-05 1.462960344e-04 2.223072612e-04 4.52 -3.829843064e-05 1.266484715e-04 1.922467873e-04 4.54 -3.266435526e-05 1.086942329e-04 1.647812481e-04 4.56 -2.750884477e-05 9.182937659e-05 1.390254857e-04 4.58 -2.283327348e-05 7.674036703e-05 1.160186951e-04 4.60 -1.863964292e-05 6.316802736e-05 9.536951037e-05 4.62 -1.492307107e-05 5.061472754e-05 7.632249425e-05 4.64 -1.167669683e-05 3.955082396e-05 5.957260556e-05 4.66 -8.889328908e-06 3.031487829e-05 4.561527559e-05 4.68 -6.545184468e-06 2.255398693e-05 3.390826515e-05 4.70 -4.621878995e-06 1.542085197e-05 2.316921070e-05 4.72 -3.092012253e-06 1.060285746e-05 1.592115714e-05 4.74 -1.925535910e-06 6.196700103e-06 9.301409059e-06 4.76 -1.085504471e-06 4.138129487e-06 6.209255124e-06 4.78 -5.262660558e-07 1.566227949e-06 2.349791046e-06 4.80 -1.980394121e-07 1.007475679e-06 1.511285050e-06 4.82 -4.472260683e-08 -1.107415753e-07 -1.661103325e-07 4.84 -1.407476326e-09 -4.585360799e-08 -6.878041786e-08 4.86 1.174405760e-14 1.174405760e-14 1.174405760e-14 4.88 1.174405760e-14 1.174405760e-14 1.174405760e-14 4.90 1.174405760e-14 1.174405760e-14 1.174405760e-14 4.92 1.174405760e-14 1.174405760e-14 1.174405760e-14 4.94 1.174405760e-14 1.174405760e-14 1.174405760e-14 4.96 1.174405760e-14 1.174405760e-14 1.174405760e-14 4.98 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.00 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.02 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.04 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.06 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.08 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.10 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.12 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.14 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.16 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.18 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.20 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.22 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.24 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.26 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.28 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.30 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.32 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.34 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.36 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.38 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.40 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.42 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.44 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.46 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.48 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.50 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.52 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.54 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.56 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.58 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.60 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.62 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.64 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.66 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.68 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.70 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.72 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.74 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.76 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.78 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.80 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.82 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.84 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.86 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.88 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.90 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.92 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.94 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.96 1.174405760e-14 1.174405760e-14 1.174405760e-14 5.98 1.174405760e-14 1.174405760e-14 1.174405760e-14 6.00 1.174405760e-14 1.174405760e-14 1.174405760e-14