# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2026--Starikov-S-Grigorev-P-Lee-S-H-et-al--W-Mo-Nb-Zr-Ti-Ta # implementation = 2026--Starikov-S--W-Mo-Nb-Zr-Ti-Ta--LAMMPS--ipr1 # composition = NbTiW2 # 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 2025-12-17 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 1.049930834e+03 1.049930834e+03 1.08 9.201490643e+02 9.201490643e+02 1.10 8.069291416e+02 8.069291416e+02 1.12 7.087810633e+02 7.087810633e+02 1.14 6.230366739e+02 6.230366739e+02 1.16 5.488666720e+02 5.488666720e+02 1.18 4.843359131e+02 4.843359131e+02 1.20 4.273766854e+02 4.273766854e+02 1.22 3.780570472e+02 3.780570472e+02 1.24 3.353586678e+02 3.353586678e+02 1.26 2.979403714e+02 2.979403714e+02 1.28 2.656192640e+02 2.656192640e+02 1.30 2.374811259e+02 2.374811259e+02 1.32 2.123134880e+02 2.123134880e+02 1.34 1.899025471e+02 1.899025471e+02 1.36 1.702989552e+02 1.702989552e+02 1.38 1.536626352e+02 1.536626352e+02 1.40 1.389240979e+02 1.389240979e+02 1.42 1.254618378e+02 1.254618378e+02 1.44 1.134825975e+02 1.134825975e+02 1.46 1.029370339e+02 1.029370339e+02 1.48 9.391769945e+01 9.391769945e+01 1.50 8.598798351e+01 8.598798351e+01 1.52 7.852665394e+01 7.852665394e+01 1.54 7.171561368e+01 7.171561368e+01 1.56 6.542000069e+01 6.542000069e+01 1.58 5.959158949e+01 5.959158949e+01 1.60 5.433096979e+01 5.433096979e+01 1.62 4.969711668e+01 4.969711668e+01 1.64 4.544639828e+01 4.544639828e+01 1.66 4.146844103e+01 4.146844103e+01 1.68 3.780067516e+01 3.780067516e+01 1.70 3.442728069e+01 3.442728069e+01 1.72 3.136363956e+01 3.136363956e+01 1.74 2.860740536e+01 2.860740536e+01 1.76 2.612645282e+01 2.612645282e+01 1.78 2.396689511e+01 2.396689511e+01 1.80 2.209874768e+01 2.209874768e+01 1.82 2.020934679e+01 2.020934679e+01 1.84 1.841773413e+01 1.841773413e+01 1.86 1.686295232e+01 1.686295232e+01 1.88 1.548289503e+01 1.548289503e+01 1.90 1.420889468e+01 1.420889468e+01 1.92 1.300502199e+01 1.300502199e+01 1.94 1.191604063e+01 1.191604063e+01 1.96 1.089495971e+01 1.089495971e+01 1.98 9.943993782e+00 9.943993782e+00 2.00 9.088642742e+00 9.088642742e+00 2.02 8.365881897e+00 8.365881897e+00 2.04 7.771768333e+00 7.771768333e+00 2.06 7.117148689e+00 7.117148689e+00 2.08 6.256169931e+00 6.256169931e+00 2.10 5.357318341e+00 5.357318341e+00 2.12 4.479927416e+00 4.479927416e+00 2.14 3.655513951e+00 3.655513951e+00 2.16 2.886506699e+00 2.886506699e+00 2.18 2.160388636e+00 2.160388636e+00 2.20 1.465061853e+00 1.465061853e+00 2.22 8.207856747e-01 8.207856747e-01 2.24 2.262752852e-01 2.262752852e-01 2.26 -3.418389590e-01 -3.418389590e-01 2.28 -8.269549734e-01 -8.269549734e-01 2.30 -1.311959783e+00 -1.311959783e+00 2.32 -2.044713054e+00 -2.044713054e+00 2.34 -2.763648261e+00 -2.763648261e+00 2.36 -3.512862827e+00 -3.512862827e+00 2.38 -4.220960951e+00 -4.220960951e+00 2.40 -4.780911758e+00 -4.780911758e+00 2.42 -5.150798175e+00 -5.150798175e+00 2.44 -5.373374992e+00 -5.373374992e+00 2.46 -5.576759266e+00 -5.576759266e+00 2.48 -5.846003750e+00 -5.846003750e+00 2.50 -6.113667011e+00 -6.113667011e+00 2.52 -6.374935675e+00 -6.374935675e+00 2.54 -6.592355745e+00 -6.592355745e+00 2.56 -6.790754494e+00 -6.790754494e+00 2.58 -6.973558456e+00 -6.973558456e+00 2.60 -7.131609161e+00 -7.131609161e+00 2.62 -7.261762961e+00 -7.261762961e+00 2.64 -7.365413498e+00 -7.365413498e+00 2.66 -7.435449613e+00 -7.435449613e+00 2.68 -7.478591178e+00 -7.478591178e+00 2.70 -7.504132832e+00 -7.504132832e+00 2.72 -7.518681090e+00 -7.518681090e+00 2.74 -7.525223705e+00 -7.525223705e+00 2.76 -7.529808020e+00 -7.529808020e+00 2.78 -7.535692175e+00 -7.535692175e+00 2.80 -7.539693973e+00 -7.539693973e+00 2.82 -7.538116293e+00 -7.538116293e+00 2.84 -7.526682423e+00 -7.526682423e+00 2.86 -7.499349659e+00 -7.499349659e+00 2.88 -7.460828164e+00 -7.460828164e+00 2.90 -7.409196040e+00 -7.409196040e+00 2.92 -7.342807501e+00 -7.342807501e+00 2.94 -7.270358809e+00 -7.270358809e+00 2.96 -7.188233674e+00 -7.188233674e+00 2.98 -7.097726830e+00 -7.097726830e+00 3.00 -7.009416763e+00 -7.009416763e+00 3.02 -6.938616084e+00 -6.938616084e+00 3.04 -6.894324033e+00 -6.894324033e+00 3.06 -6.868798214e+00 -6.868798214e+00 3.08 -6.846524691e+00 -6.846524691e+00 3.10 -6.811865629e+00 -6.811865629e+00 3.12 -6.751271885e+00 -6.751271885e+00 3.14 -6.658634836e+00 -6.658634836e+00 3.16 -6.528950070e+00 -6.528950070e+00 3.18 -6.370061668e+00 -6.370061668e+00 3.20 -6.207002940e+00 -6.207002940e+00 3.22 -6.069795779e+00 -6.069795779e+00 3.24 -5.992117361e+00 -5.992117361e+00 3.26 -5.952460251e+00 -5.952460251e+00 3.28 -5.912120704e+00 -5.912120704e+00 3.30 -5.857194513e+00 -5.857194513e+00 3.32 -5.757969496e+00 -5.757969496e+00 3.34 -5.665852804e+00 -5.665852804e+00 3.36 -5.575986386e+00 -5.575986386e+00 3.38 -5.493563824e+00 -5.493563824e+00 3.40 -5.434588013e+00 -5.434588013e+00 3.42 -5.364313417e+00 -5.364313417e+00 3.44 -5.239610558e+00 -5.239610558e+00 3.46 -5.101185403e+00 -5.101185403e+00 3.48 -4.961068049e+00 -4.961068049e+00 3.50 -4.820779564e+00 -4.820779564e+00 3.52 -4.688041781e+00 -4.688041781e+00 3.54 -4.572488158e+00 -4.572488158e+00 3.56 -4.486034706e+00 -4.486034706e+00 3.58 -4.428363997e+00 -4.428363997e+00 3.60 -4.385383827e+00 -4.385383827e+00 3.62 -4.341831852e+00 -4.341831852e+00 3.64 -4.282403747e+00 -4.282403747e+00 3.66 -4.203023228e+00 -4.203023228e+00 3.68 -4.113936678e+00 -4.113936678e+00 3.70 -4.025301196e+00 -4.025301196e+00 3.72 -3.947821198e+00 -3.947821198e+00 3.74 -3.886153711e+00 -3.886153711e+00 3.76 -3.832771395e+00 -3.832771395e+00 3.78 -3.776261881e+00 -3.776261881e+00 3.80 -3.701906351e+00 -3.701906351e+00 3.82 -3.608630190e+00 -3.608630190e+00 3.84 -3.505834462e+00 -3.505834462e+00 3.86 -3.393331953e+00 -3.393331953e+00 3.88 -3.267674578e+00 -3.267674578e+00 3.90 -3.135390126e+00 -3.135390126e+00 3.92 -3.004660541e+00 -3.004660541e+00 3.94 -2.884334524e+00 -2.884334524e+00 3.96 -2.774349529e+00 -2.774349529e+00 3.98 -2.669404361e+00 -2.669404361e+00 4.00 -2.576088232e+00 -2.576088232e+00 4.02 -2.499804411e+00 -2.499804411e+00 4.04 -2.437852365e+00 -2.437852365e+00 4.06 -2.383357227e+00 -2.383357227e+00 4.08 -2.330473456e+00 -2.330473456e+00 4.10 -2.277519930e+00 -2.277519930e+00 4.12 -2.227406523e+00 -2.227406523e+00 4.14 -2.183060123e+00 -2.183060123e+00 4.16 -2.146211801e+00 -2.146211801e+00 4.18 -2.117198007e+00 -2.117198007e+00 4.20 -2.093356325e+00 -2.093356325e+00 4.22 -2.074902721e+00 -2.074902721e+00 4.24 -2.063094354e+00 -2.063094354e+00 4.26 -2.059043445e+00 -2.059043445e+00 4.28 -2.063641062e+00 -2.063641062e+00 4.30 -2.076916547e+00 -2.076916547e+00 4.32 -2.097721298e+00 -2.097721298e+00 4.34 -2.123804198e+00 -2.123804198e+00 4.36 -2.152350828e+00 -2.152350828e+00 4.38 -2.180521642e+00 -2.180521642e+00 4.40 -2.206055746e+00 -2.206055746e+00 4.42 -2.227491254e+00 -2.227491254e+00 4.44 -2.244098792e+00 -2.244098792e+00 4.46 -2.255714901e+00 -2.255714901e+00 4.48 -2.263152243e+00 -2.263152243e+00 4.50 -2.268068122e+00 -2.268068122e+00 4.52 -2.271983955e+00 -2.271983955e+00 4.54 -2.276307368e+00 -2.276307368e+00 4.56 -2.282504797e+00 -2.282504797e+00 4.58 -2.291609524e+00 -2.291609524e+00 4.60 -2.303650604e+00 -2.303650604e+00 4.62 -2.317355556e+00 -2.317355556e+00 4.64 -2.330137674e+00 -2.330137674e+00 4.66 -2.339148537e+00 -2.339148537e+00 4.68 -2.341503594e+00 -2.341503594e+00 4.70 -2.335205841e+00 -2.335205841e+00 4.72 -2.319516680e+00 -2.319516680e+00 4.74 -2.294328250e+00 -2.294328250e+00 4.76 -2.261611471e+00 -2.261611471e+00 4.78 -2.224251549e+00 -2.224251549e+00 4.80 -2.185097381e+00 -2.185097381e+00 4.82 -2.145744278e+00 -2.145744278e+00 4.84 -2.106611843e+00 -2.106611843e+00 4.86 -2.068017226e+00 -2.068017226e+00 4.88 -2.029713865e+00 -2.029713865e+00 4.90 -1.989705347e+00 -1.989705347e+00 4.92 -1.945929491e+00 -1.945929491e+00 4.94 -1.899074961e+00 -1.899074961e+00 4.96 -1.850022327e+00 -1.850022327e+00 4.98 -1.800762652e+00 -1.800762652e+00 5.00 -1.757211757e+00 -1.757211757e+00 5.02 -1.726990474e+00 -1.726990474e+00 5.04 -1.714059188e+00 -1.714059188e+00 5.06 -1.713767516e+00 -1.713767516e+00 5.08 -1.719562449e+00 -1.719562449e+00 5.10 -1.724783606e+00 -1.724783606e+00 5.12 -1.722606223e+00 -1.722606223e+00 5.14 -1.706217023e+00 -1.706217023e+00 5.16 -1.671776697e+00 -1.671776697e+00 5.18 -1.623909980e+00 -1.623909980e+00 5.20 -1.569830476e+00 -1.569830476e+00 5.22 -1.516206067e+00 -1.516206067e+00 5.24 -1.462462505e+00 -1.462462505e+00 5.26 -1.410987337e+00 -1.410987337e+00 5.28 -1.369329984e+00 -1.369329984e+00 5.30 -1.339500919e+00 -1.339500919e+00 5.32 -1.319335729e+00 -1.319335729e+00 5.34 -1.304632545e+00 -1.304632545e+00 5.36 -1.290711092e+00 -1.290711092e+00 5.38 -1.273548648e+00 -1.273548648e+00 5.40 -1.252620728e+00 -1.252620728e+00 5.42 -1.227936693e+00 -1.227936693e+00 5.44 -1.200076863e+00 -1.200076863e+00 5.46 -1.169495340e+00 -1.169495340e+00 5.48 -1.136260488e+00 -1.136260488e+00 5.50 -1.100500567e+00 -1.100500567e+00 5.52 -1.062673801e+00 -1.062673801e+00 5.54 -1.023613556e+00 -1.023613556e+00 5.56 -9.833646164e-01 -9.833646164e-01 5.58 -9.407979807e-01 -9.407979807e-01 5.60 -8.950522355e-01 -8.950522355e-01 5.62 -8.454237128e-01 -8.454237128e-01 5.64 -7.896810756e-01 -7.896810756e-01 5.66 -7.251114113e-01 -7.251114113e-01 5.68 -6.490498947e-01 -6.490498947e-01 5.70 -5.636538730e-01 -5.636538730e-01 5.72 -4.744908476e-01 -4.744908476e-01 5.74 -3.895573343e-01 -3.895573343e-01 5.76 -3.211081489e-01 -3.211081489e-01 5.78 -2.793135594e-01 -2.793135594e-01 5.80 -2.737509257e-01 -2.737509257e-01 5.82 -3.073574907e-01 -3.073574907e-01 5.84 -3.686958300e-01 -3.686958300e-01 5.86 -4.415906937e-01 -4.415906937e-01 5.88 -5.126327004e-01 -5.126327004e-01 5.90 -5.734581769e-01 -5.734581769e-01 5.92 -6.180808890e-01 -6.180808890e-01 5.94 -6.408933683e-01 -6.408933683e-01 5.96 -6.395239838e-01 -6.395239838e-01 5.98 -6.151302370e-01 -6.151302370e-01 6.00 -5.682933936e-01 -5.682933936e-01