# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2025--Kushnerov-O-I-Ryabtsev-S-I-Bashev-V-F--Co-Cr-Fe-Ni-Mn-Al # implementation = 2025--Kushnerov-O-I--Co-Cr-Fe-Ni-Mn-Al--LAMMPS--ipr1 # composition = Co2FeNi # 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 2025-07-01 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 2.119880009e+02 2.119880009e+02 1.10 1.952021857e+02 1.952021857e+02 1.12 1.795102028e+02 1.795102028e+02 1.14 1.650197077e+02 1.650197077e+02 1.16 1.518654108e+02 1.518654108e+02 1.18 1.396857554e+02 1.396857554e+02 1.20 1.288230817e+02 1.288230817e+02 1.22 1.184654565e+02 1.184654565e+02 1.24 1.088352929e+02 1.088352929e+02 1.26 1.001192163e+02 1.001192249e+02 1.28 9.203461366e+01 9.203461366e+01 1.30 8.457865208e+01 8.457865208e+01 1.32 7.757391553e+01 7.757391553e+01 1.34 7.135123624e+01 7.135123624e+01 1.36 6.535357165e+01 6.535357165e+01 1.38 5.983550886e+01 5.983550886e+01 1.40 5.471803554e+01 5.471803554e+01 1.42 4.999012628e+01 4.999012628e+01 1.44 4.585558912e+01 4.585558912e+01 1.46 4.196514410e+01 4.196514410e+01 1.48 3.818953247e+01 3.818953247e+01 1.50 3.470063169e+01 3.470063169e+01 1.52 3.156106948e+01 3.156106948e+01 1.54 2.873660194e+01 2.873660194e+01 1.56 2.595750448e+01 2.595750448e+01 1.58 2.341871831e+01 2.341871831e+01 1.60 2.104426128e+01 2.104426128e+01 1.62 1.885131225e+01 1.885131225e+01 1.64 1.682637562e+01 1.682637562e+01 1.66 1.503837691e+01 1.503837691e+01 1.68 1.338602687e+01 1.338602687e+01 1.70 1.177919175e+01 1.177919175e+01 1.72 1.029763535e+01 1.029763535e+01 1.74 9.014085227e+00 9.014085227e+00 1.76 7.748578955e+00 7.748578955e+00 1.78 6.583631710e+00 6.583631710e+00 1.80 5.511936585e+00 5.511936585e+00 1.82 4.635960255e+00 4.635960255e+00 1.84 3.721178914e+00 3.721178914e+00 1.86 3.045143236e+00 3.045143236e+00 1.88 2.261029325e+00 2.261029325e+00 1.90 1.542987539e+00 1.542987539e+00 1.92 8.862156497e-01 8.862156497e-01 1.94 3.281905618e-01 3.281905618e-01 1.96 -2.226387334e-01 -2.226387334e-01 1.98 -7.243192957e-01 -7.243192957e-01 2.00 -1.180437332e+00 -1.180437332e+00 2.02 -1.594323083e+00 -1.594323083e+00 2.04 -1.969069946e+00 -1.969069946e+00 2.06 -2.307552050e+00 -2.307552050e+00 2.08 -2.612440427e+00 -2.612440427e+00 2.10 -2.812630221e+00 -2.812630428e+00 2.12 -3.023246700e+00 -3.023246700e+00 2.14 -3.250015457e+00 -3.250015457e+00 2.16 -3.451465068e+00 -3.451465068e+00 2.18 -3.629503410e+00 -3.629503410e+00 2.20 -3.785904932e+00 -3.785904932e+00 2.22 -3.922320130e+00 -3.922320130e+00 2.24 -3.956384249e+00 -3.956384249e+00 2.26 -4.063525083e+00 -4.063525083e+00 2.28 -4.154515211e+00 -4.154515211e+00 2.30 -4.230624019e+00 -4.230624019e+00 2.32 -4.293032294e+00 -4.293032294e+00 2.34 -4.342838356e+00 -4.342838356e+00 2.36 -4.381063763e+00 -4.381063763e+00 2.38 -4.408658595e+00 -4.408658595e+00 2.40 -4.426506362e+00 -4.426506362e+00 2.42 -4.435428567e+00 -4.435428567e+00 2.44 -4.348257046e+00 -4.348257046e+00 2.46 -4.347517629e+00 -4.347517629e+00 2.48 -4.339584586e+00 -4.339584586e+00 2.50 -4.325097762e+00 -4.325097762e+00 2.52 -4.221672630e+00 -4.221672630e+00 2.54 -4.201303175e+00 -4.201303175e+00 2.56 -4.175678232e+00 -4.175678232e+00 2.58 -4.145297368e+00 -4.145297368e+00 2.60 -4.110624326e+00 -4.110624326e+00 2.62 -4.072089423e+00 -4.072089423e+00 2.64 -4.030091799e+00 -4.030091799e+00 2.66 -3.985001512e+00 -3.985001512e+00 2.68 -3.937161485e+00 -3.937161485e+00 2.70 -3.886889333e+00 -3.886889333e+00 2.72 -3.834479065e+00 -3.834479065e+00 2.74 -3.759001113e+00 -3.759001113e+00 2.76 -3.704398019e+00 -3.704398019e+00 2.78 -3.648334582e+00 -3.648334582e+00 2.80 -3.591029929e+00 -3.591029929e+00 2.82 -3.532686258e+00 -3.532686258e+00 2.84 -3.473489981e+00 -3.473489981e+00 2.86 -3.413612795e+00 -3.413612795e+00 2.88 -3.353212678e+00 -3.353212678e+00 2.90 -3.292434826e+00 -3.292434826e+00 2.92 -3.231412519e+00 -3.231412519e+00 2.94 -3.170267942e+00 -3.170267942e+00 2.96 -3.109112945e+00 -3.109112945e+00 2.98 -3.048049752e+00 -3.048049752e+00 3.00 -2.987171631e+00 -2.987171631e+00 3.02 -2.926563513e+00 -2.926563513e+00 3.04 -2.866302574e+00 -2.866302574e+00 3.06 -2.806458777e+00 -2.806458777e+00 3.08 -2.747095383e+00 -2.747095383e+00 3.10 -2.688269423e+00 -2.688269423e+00 3.12 -2.630032142e+00 -2.630032142e+00 3.14 -2.572429412e+00 -2.572429412e+00 3.16 -2.486974335e+00 -2.486974335e+00 3.18 -2.432266398e+00 -2.432266398e+00 3.20 -2.378222768e+00 -2.378222768e+00 3.22 -2.324875609e+00 -2.324875609e+00 3.24 -2.272253198e+00 -2.272253198e+00 3.26 -2.220380210e+00 -2.220380210e+00 3.28 -2.169277987e+00 -2.169277987e+00 3.30 -2.033371227e+00 -2.033371227e+00 3.32 -1.988200772e+00 -1.988200772e+00 3.34 -1.943628476e+00 -1.943628476e+00 3.36 -1.899675665e+00 -1.899675665e+00 3.38 -1.856360888e+00 -1.856360888e+00 3.40 -1.813700114e+00 -1.813700114e+00 3.42 -1.771706931e+00 -1.771706931e+00 3.44 -1.730392716e+00 -1.730392716e+00 3.46 -1.689766808e+00 -1.689766808e+00 3.48 -1.649836659e+00 -1.649836659e+00 3.50 -1.610607986e+00 -1.610607986e+00 3.52 -1.572084901e+00 -1.572084901e+00 3.54 -1.534270045e+00 -1.534270045e+00 3.56 -1.497164702e+00 -1.497164702e+00 3.58 -1.460768912e+00 -1.460768912e+00 3.60 -1.425081577e+00 -1.425081577e+00 3.62 -1.390100557e+00 -1.390100557e+00 3.64 -1.355822758e+00 -1.355822758e+00 3.66 -1.322244222e+00 -1.322244222e+00 3.68 -1.289360200e+00 -1.289360200e+00 3.70 -1.257165230e+00 -1.257165230e+00 3.72 -1.225653204e+00 -1.225653204e+00 3.74 -1.194817432e+00 -1.194817432e+00 3.76 -1.164650700e+00 -1.164650700e+00 3.78 -1.135145327e+00 -1.135145327e+00 3.80 -1.106293216e+00 -1.106293216e+00 3.82 -1.078085901e+00 -1.078085901e+00 3.84 -1.050514593e+00 -1.050514593e+00 3.86 -9.797396647e-01 -9.797396647e-01 3.88 -9.553125944e-01 -9.553125944e-01 3.90 -9.314115918e-01 -9.314115918e-01 3.92 -9.080304675e-01 -9.080304675e-01 3.94 -8.851627378e-01 -8.851627378e-01 3.96 -8.628016580e-01 -8.628016580e-01 3.98 -8.409402550e-01 -8.409402550e-01 4.00 -8.195713558e-01 -8.195713558e-01 4.02 -7.986876157e-01 -7.986876157e-01 4.04 -7.782815429e-01 -7.782815429e-01 4.06 -7.583455224e-01 -7.583455224e-01 4.08 -7.388718378e-01 -7.388718378e-01 4.10 -7.198526911e-01 -7.198526911e-01 4.12 -7.012802220e-01 -7.012802220e-01 4.14 -6.831465244e-01 -6.831465244e-01 4.16 -6.654436626e-01 -6.654436626e-01 4.18 -6.481636860e-01 -6.481636860e-01 4.20 -6.312986425e-01 -6.312986425e-01 4.22 -6.148405908e-01 -6.148405908e-01 4.24 -5.987816118e-01 -5.987816118e-01 4.26 -5.831138186e-01 -5.831138186e-01 4.28 -5.678293668e-01 -5.678293668e-01 4.30 -5.529204624e-01 -5.529204624e-01 4.32 -5.383793698e-01 -5.383793698e-01 4.34 -5.241984193e-01 -5.241984193e-01 4.36 -5.103700131e-01 -5.103700131e-01 4.38 -4.968866313e-01 -4.968866313e-01 4.40 -4.837408370e-01 -4.837408370e-01 4.42 -4.709252813e-01 -4.709252813e-01 4.44 -4.584327069e-01 -4.584327069e-01 4.46 -4.462559524e-01 -4.462559524e-01 4.48 -4.343879547e-01 -4.343879547e-01 4.50 -4.228217528e-01 -4.228217528e-01 4.52 -4.115504893e-01 -4.115504893e-01 4.54 -4.005674131e-01 -4.005674131e-01 4.56 -3.898658808e-01 -3.898658808e-01 4.58 -3.794393582e-01 -3.794393582e-01 4.60 -3.692814214e-01 -3.692814214e-01 4.62 -3.593857579e-01 -3.593857579e-01 4.64 -3.497461670e-01 -3.497461670e-01 4.66 -3.403565601e-01 -3.403565601e-01 4.68 -3.312109613e-01 -3.312109613e-01 4.70 -3.223035071e-01 -3.223035071e-01 4.72 -3.136284464e-01 -3.136284464e-01 4.74 -3.051801399e-01 -3.051801399e-01 4.76 -2.969530602e-01 -2.969530602e-01 4.78 -2.889417905e-01 -2.889417905e-01 4.80 -2.811410244e-01 -2.811410244e-01 4.82 -2.735455649e-01 -2.735455649e-01 4.84 -2.661503234e-01 -2.661503234e-01 4.86 -2.589503189e-01 -2.589503189e-01 4.88 -2.519406764e-01 -2.519406764e-01 4.90 -2.451166264e-01 -2.451166264e-01 4.92 -2.384735032e-01 -2.384735032e-01 4.94 -2.320067436e-01 -2.320067436e-01 4.96 -2.257118858e-01 -2.257118858e-01 4.98 -2.195845677e-01 -2.195845677e-01 5.00 -2.136205259e-01 -2.136205259e-01 5.02 -2.078155936e-01 -2.078155936e-01 5.04 -2.021656998e-01 -2.021656998e-01 5.06 -1.966668670e-01 -1.966668670e-01 5.08 -1.913152105e-01 -1.913152105e-01 5.10 -1.861069361e-01 -1.861069361e-01 5.12 -1.810383391e-01 -1.810383391e-01 5.14 -1.761058021e-01 -1.761058021e-01 5.16 -1.713057942e-01 -1.713057942e-01 5.18 -1.666348685e-01 -1.666348685e-01 5.20 -1.620896615e-01 -1.620896615e-01 5.22 -1.576668905e-01 -1.576668905e-01 5.24 -1.533633529e-01 -1.533633529e-01 5.26 -1.491759240e-01 -1.491759240e-01 5.28 -1.451015557e-01 -1.451015557e-01 5.30 -1.411372749e-01 -1.411372749e-01 5.32 -1.372801821e-01 -1.372801821e-01 5.34 -1.335274495e-01 -1.335274495e-01 5.36 -1.298763198e-01 -1.298763198e-01 5.38 -1.263241046e-01 -1.263241046e-01 5.40 -1.228681830e-01 -1.228681830e-01 5.42 -1.195059999e-01 -1.195059999e-01 5.44 -1.162350646e-01 -1.162350646e-01 5.46 -9.120713884e-02 -9.120713884e-02 5.48 -8.878558635e-02 -8.878558635e-02 5.50 -8.642746338e-02 -8.642746338e-02 5.52 -8.413115494e-02 -8.413115494e-02 5.54 -8.189508462e-02 -8.189508462e-02 5.56 -7.971771379e-02 -7.971771379e-02 5.58 -7.759754089e-02 -7.759754089e-02 5.60 -7.553310060e-02 -7.553310060e-02 5.62 -7.352296314e-02 -7.352296314e-02 5.64 -7.156573346e-02 -7.156573346e-02 5.66 -6.966005057e-02 -6.966005057e-02 5.68 -6.780458675e-02 -6.780458675e-02 5.70 -6.599804689e-02 -6.599804689e-02 5.72 -6.423916772e-02 -6.423916772e-02 5.74 -6.252671714e-02 -6.252671714e-02 5.76 -6.085949356e-02 -6.085949356e-02 5.78 -5.923632515e-02 -5.923632515e-02 5.80 -5.765606924e-02 -5.765606924e-02 5.82 -5.611761164e-02 -5.611761164e-02 5.84 -5.461986599e-02 -5.461986599e-02 5.86 -5.316177310e-02 -5.316177310e-02 5.88 -5.174230039e-02 -5.174230039e-02 5.90 -5.036044123e-02 -5.036044123e-02 5.92 -4.901521434e-02 -4.901521434e-02 5.94 -4.770566320e-02 -4.770566320e-02 5.96 -4.643085551e-02 -4.643085551e-02 5.98 -4.518988256e-02 -4.518988256e-02 6.00 -4.398185872e-02 -4.398185872e-02