# Potential energy (eV/atom) vs. nearest neighbor radial distance (Angstrom). # potential = 2023--Daw-M-S-Chandross-M--Cu-Ag-Au-Ni-Pd-Pt # implementation = 2023--Daw-M-S--Cu-Ag-Au-Ni-Pd-Pt--LAMMPS--ipr1 # composition = Cu # 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 2026-08-31 r A1--Cu--fcc A15--beta-W A2--W--bcc A3'--alpha-La--d A3--Mg--hcp A4--C--dc A5--beta-Sn A6--In--bct A7--alpha-As Ah--alpha-Po--sc 0.50 nan nan nan nan nan nan nan nan nan nan 0.52 nan nan nan nan nan nan nan nan nan nan 0.54 nan nan nan nan nan nan nan nan nan nan 0.56 nan nan nan nan nan nan nan nan nan nan 0.58 nan nan nan nan nan nan nan nan nan nan 0.60 nan nan nan nan nan nan nan nan nan nan 0.62 nan nan nan nan nan nan nan nan nan nan 0.64 nan nan nan nan nan nan nan nan nan nan 0.66 nan nan nan nan nan nan nan nan nan nan 0.68 nan nan nan nan nan 2.304515165e+06 nan nan nan nan 0.70 nan nan nan nan nan 2.021014534e+06 nan nan nan nan 0.72 nan nan nan nan nan 1.768527889e+06 nan nan 2.194614916e+06 nan 0.74 nan nan nan nan nan 1.542952184e+06 nan nan 1.934000606e+06 nan 0.76 nan nan nan nan nan 1.340829763e+06 nan nan 1.700386808e+06 nan 0.78 nan 2.358084263e+06 nan nan nan 1.159187726e+06 nan nan 1.490393871e+06 2.361547238e+06 0.80 nan 2.103761152e+06 nan nan nan 9.955631342e+05 2.151084065e+06 nan 1.301194474e+06 2.107297153e+06 0.82 nan 1.873919687e+06 nan nan nan 8.478069807e+05 1.918000448e+06 nan 1.130308612e+06 1.877521305e+06 0.84 nan 1.665721965e+06 nan nan nan 7.141362570e+05 1.706847066e+06 nan 9.756104977e+05 1.669373182e+06 0.86 nan 1.476692279e+06 2.250396577e+06 nan nan 5.929355486e+05 1.515128217e+06 2.339453282e+06 8.352630890e+05 1.480405493e+06 0.88 2.304753503e+06 1.304717734e+06 2.025907734e+06 2.304704545e+06 2.304697652e+06 4.827454250e+05 1.340692871e+06 2.108921028e+06 7.076548819e+05 1.308446494e+06 0.90 2.081521053e+06 1.147939702e+06 1.821095776e+06 2.081513686e+06 2.081527179e+06 3.823544414e+05 1.181662223e+06 1.898634728e+06 5.913650743e+05 1.151651839e+06 0.92 1.877455262e+06 1.004715665e+06 1.633940206e+06 1.877510136e+06 1.877535287e+06 2.907400284e+05 1.036361163e+06 1.706468791e+06 4.851876665e+05 1.008479122e+06 0.94 1.690627710e+06 8.736473655e+05 1.462628816e+06 1.690696856e+06 1.690715523e+06 2.144013163e+05 9.033895423e+05 1.530559956e+06 3.880806637e+05 8.774792874e+05 0.96 1.519316198e+06 7.534947426e+05 1.305548437e+06 1.519343753e+06 1.519354276e+06 1.586714516e+05 7.814939409e+05 1.369236301e+06 2.991154242e+05 7.573822423e+05 0.98 1.361908790e+06 6.431511539e+05 1.161203448e+06 1.361894708e+06 1.361892596e+06 1.178363147e+05 6.695700898e+05 1.221008597e+06 2.230418941e+05 6.471270791e+05 1.00 1.217026695e+06 5.416823425e+05 1.028383587e+06 1.216971431e+06 1.216961254e+06 8.779649570e+04 5.666516055e+05 1.084575560e+06 1.666949061e+05 5.456992667e+05 1.02 1.083433073e+06 4.482089846e+05 9.059536255e+05 1.083383208e+06 1.083374885e+06 6.561402022e+04 4.718682608e+05 9.587879725e+05 1.249729600e+05 4.522274429e+05 1.04 9.600816540e+05 3.619739615e+05 7.929247675e+05 9.600793758e+05 9.600809641e+05 4.916891788e+04 3.844128711e+05 8.426729568e+05 9.396575910e+04 3.659696867e+05 1.06 8.460377214e+05 2.822963593e+05 6.884433850e+05 8.460787390e+05 8.460917296e+05 3.693904182e+04 3.035776362e+05 7.353508581e+05 7.083989215e+04 2.862889869e+05 1.08 7.404630227e+05 2.157103902e+05 5.917030005e+05 7.405238608e+05 7.405506483e+05 2.781795616e+04 2.326201188e+05 6.360087013e+05 5.353652717e+04 2.189920832e+05 1.10 6.426128544e+05 1.652664098e+05 5.020418710e+05 6.426673267e+05 6.426964560e+05 2.099733593e+04 1.784060915e+05 5.439398550e+05 4.055127498e+04 1.679739267e+05 1.12 5.517998579e+05 1.269299990e+05 4.188748132e+05 5.518322185e+05 5.518523203e+05 1.588461802e+04 1.371730386e+05 4.585070761e+05 3.077821309e+04 1.291656573e+05 1.14 4.674277191e+05 9.770872112e+04 3.416380020e+05 4.674262770e+05 4.674336941e+05 1.204177644e+04 1.057199229e+05 3.791396293e+05 2.340326415e+04 9.955689817e+04 1.16 3.889391535e+05 7.536653364e+04 2.700412096e+05 3.889088093e+05 3.889064084e+05 9.144760044e+03 8.165489830e+04 3.053031055e+05 1.782301156e+04 7.690521678e+04 1.18 3.158157323e+05 5.824342421e+04 2.110797532e+05 3.157806972e+05 3.157723196e+05 6.953981134e+03 6.319675622e+04 2.393688177e+05 1.359202459e+04 5.953006964e+04 1.20 2.492895624e+05 4.509359528e+04 1.653536006e+05 2.492646357e+05 2.492533420e+05 5.294315135e+03 4.900587112e+04 1.876924691e+05 1.037886551e+04 4.616563878e+04 1.22 1.963243178e+05 3.496943211e+04 1.297957331e+05 1.963077579e+05 1.962975331e+05 4.035183534e+03 3.806881637e+04 1.474700325e+05 7.934464601e+03 3.586178939e+04 1.24 1.549114474e+05 2.715693946e+04 1.020637567e+05 1.549088229e+05 1.549045832e+05 3.078123532e+03 2.962015216e+04 1.160859524e+05 6.072154107e+03 2.789619171e+04 1.26 1.224622223e+05 2.111850575e+04 8.039258897e+04 1.224714228e+05 1.224753410e+05 2.349871847e+03 2.307760085e+04 9.154399281e+04 4.651260783e+03 2.172800434e+04 1.28 9.698347101e+04 1.644287155e+04 6.342556045e+04 9.699913122e+04 9.700800273e+04 1.795143246e+03 1.800053692e+04 7.231549202e+04 3.565235613e+03 1.694428334e+04 1.30 7.693581746e+04 1.281454439e+04 5.011881723e+04 7.695200858e+04 7.696227410e+04 1.372295316e+03 1.405448869e+04 5.721759337e+04 2.734243000e+03 1.322927089e+04 1.32 6.112275656e+04 9.995306300e+03 3.966249162e+04 6.113960393e+04 6.114965140e+04 1.049766916e+03 1.098367225e+04 4.533863491e+04 2.097834443e+03 1.034049271e+04 1.34 4.862971843e+04 7.802515409e+03 3.142764773e+04 4.864386429e+04 4.865204734e+04 8.035178952e+02 8.591282154e+03 3.597620121e+04 1.610040549e+03 8.091065643e+03 1.36 3.874466941e+04 6.095307779e+03 2.493228650e+04 3.875357603e+04 3.875915667e+04 6.153920790e+02 6.724830897e+03 2.858390031e+04 1.235802540e+03 6.335441194e+03 1.38 3.091162771e+04 4.764101667e+03 1.980130311e+04 3.091281396e+04 3.091561132e+04 4.715592380e+02 5.267060438e+03 2.273708635e+04 9.485348636e+02 4.963720000e+03 1.40 2.469094545e+04 3.724539328e+03 1.574153444e+04 2.468646394e+04 2.468701726e+04 3.614725733e+02 4.127367723e+03 1.810394364e+04 7.279785727e+02 3.890755932e+03 1.42 1.973969284e+04 2.912209905e+03 1.252580718e+04 1.973400205e+04 1.973320311e+04 2.772112291e+02 3.235449739e+03 1.442674235e+04 5.585413286e+02 3.050567539e+03 1.44 1.579476956e+04 2.277209783e+03 9.975972079e+03 1.578969289e+04 1.578814912e+04 2.127162100e+02 2.536947123e+03 1.150497952e+04 4.283471646e+02 2.392350932e+03 1.46 1.264736684e+04 1.780587749e+03 7.951043899e+03 1.264404921e+04 1.264245993e+04 1.633485182e+02 1.989410280e+03 9.180769722e+03 3.283186993e+02 1.876393179e+03 1.48 1.013346672e+04 1.392034995e+03 6.339681479e+03 1.013197204e+04 1.013064047e+04 1.255245653e+02 1.559759607e+03 7.330190593e+03 2.514596108e+02 1.471777274e+03 1.50 8.124013547e+03 1.087833089e+03 5.055922242e+03 8.123637023e+03 8.122576076e+03 9.652935697e+01 1.222571681e+03 5.855105308e+03 1.924030488e+02 1.154405936e+03 1.52 6.516139371e+03 8.495367987e+02 4.032740529e+03 6.516454990e+03 6.515713484e+03 7.430377555e+01 9.579535725e+02 4.678298486e+03 1.470571992e+02 9.053191673e+02 1.54 5.228263166e+03 6.628946494e+02 3.216858953e+03 5.229150538e+03 5.228796033e+03 5.726173124e+01 7.503041743e+02 3.738857699e+03 1.122632760e+02 7.097067845e+02 1.56 4.196173473e+03 5.167716028e+02 2.565915292e+03 4.197414341e+03 4.197451826e+03 4.418371473e+01 5.873728930e+02 2.988593124e+03 8.557528680e+01 5.561123383e+02 1.58 3.368664395e+03 4.024280658e+02 2.046467375e+03 3.369877797e+03 3.370275479e+03 3.414268950e+01 4.595134179e+02 2.389074959e+03 6.511276913e+01 4.355312420e+02 1.60 2.704551304e+03 3.130033608e+02 1.631901709e+03 2.705677502e+03 2.706384308e+03 2.642636863e+01 3.591885803e+02 1.909660574e+03 4.943384122e+01 3.408197618e+02 1.62 2.171312054e+03 2.431099955e+02 1.301018944e+03 2.172287999e+03 2.173155506e+03 2.048772138e+01 2.804942296e+02 1.526165288e+03 3.742863094e+01 2.664408494e+02 1.64 1.743078634e+03 1.884881559e+02 1.036923024e+03 1.743775806e+03 1.744602489e+03 1.590710568e+01 2.187579646e+02 1.219315876e+03 2.824342868e+01 2.080648096e+02 1.66 1.399127175e+03 1.458197304e+02 8.261408722e+02 1.399495245e+03 1.400169447e+03 1.236301225e+01 1.703510520e+02 9.737887042e+02 2.121942734e+01 1.622781393e+02 1.68 1.122664225e+03 1.125141285e+02 6.578169911e+02 1.122792981e+03 1.123293373e+03 9.608321387e+00 1.324204866e+02 7.772419580e+02 1.584850891e+01 1.263624228e+02 1.70 9.003178968e+02 8.654294050e+01 5.233470748e+02 9.003505013e+02 9.007023630e+02 7.455392890e+00 1.027128241e+02 6.199033564e+02 1.173936874e+01 9.819260498e+01 1.72 7.215418985e+02 6.631723418e+01 4.159700909e+02 7.215645762e+02 7.217926397e+02 5.762274065e+00 7.946332092e+01 4.939994684e+02 8.592914738e+00 7.612227027e+01 1.74 5.778438080e+02 5.058689265e+01 3.302704216e+02 5.778853486e+02 5.780126445e+02 4.420519582e+00 6.128033003e+01 3.932940314e+02 6.179294915e+00 5.884972982e+01 1.76 4.623836647e+02 3.836918191e+01 2.619099079e+02 4.624194315e+02 4.624666773e+02 3.347461374e+00 4.707121575e+01 3.127834430e+02 4.322949772e+00 4.534660564e+01 1.78 3.696408692e+02 2.888938244e+01 2.073860793e+02 3.696616827e+02 3.696523990e+02 2.480115194e+00 3.597616036e+01 2.484476694e+02 2.890054925e+00 3.479790520e+01 1.80 2.951725448e+02 2.154146120e+01 1.639061090e+02 2.951796684e+02 2.951367935e+02 1.771135171e+00 2.732396415e+01 1.970635513e+02 1.778505220e+00 2.656281103e+01 1.82 2.354119262e+02 1.585395898e+01 1.292656570e+02 2.354072599e+02 2.353465573e+02 1.184849863e+00 2.058555127e+01 1.560482334e+02 9.106228061e-01 2.014033325e+01 1.84 1.874838033e+02 1.145565612e+01 1.016950333e+02 1.874694858e+02 1.874015168e+02 6.941358000e-01 1.534348959e+01 1.233149902e+02 2.274970597e-01 1.513557278e+01 1.86 1.490707025e+02 8.057168324e+00 7.977408778e+01 1.490431744e+02 1.489747739e+02 2.784228866e-01 1.126895647e+01 9.720897035e+01 -3.153876564e-01 1.123771045e+01 1.88 1.183050431e+02 5.432470161e+00 6.236376496e+01 1.182600778e+02 1.181954437e+02 -7.785233517e-02 8.104382859e+00 7.639583023e+01 -7.514515884e-01 8.202503297e+00 1.90 9.366023141e+01 3.407563270e+00 4.855102240e+01 9.360588341e+01 9.355012516e+01 -3.864434325e-01 5.647610774e+00 5.981073785e+01 -1.105645168e+00 5.838367782e+00 1.92 7.391017365e+01 1.846704672e+00 3.760449790e+01 7.386220959e+01 7.382096749e+01 -6.562174719e-01 3.740255360e+00 4.660990329e+01 -1.396682699e+00 3.995321050e+00 1.94 5.810292382e+01 6.439770662e-01 2.893713528e+01 5.806870470e+01 5.804308709e+01 -8.938652596e-01 2.258496281e+00 3.611756307e+01 -1.638548828e+00 2.556198949e+00 1.96 4.546824090e+01 -2.830255376e-01 2.207566951e+01 4.544768147e+01 4.543408358e+01 -1.104445684e+00 1.105679921e+00 2.778986911e+01 -1.841616364e+00 1.429687493e+00 1.98 3.538313450e+01 -9.982151401e-01 1.665029338e+01 3.537460787e+01 3.536971495e+01 -1.291800713e+00 2.067853718e-01 2.118960058e+01 -2.013665895e+00 5.447982815e-01 2.00 2.734418144e+01 -1.550991178e+00 1.236301695e+01 2.734425599e+01 2.734545011e+01 -1.458705456e+00 -4.963310687e-01 1.596550048e+01 -2.160492061e+00 -1.535067726e-01 2.02 2.094499595e+01 -1.979395212e+00 8.978063964e+00 2.095009485e+01 2.095533182e+01 -1.607312058e+00 -1.048458748e+00 1.183491141e+01 -2.286407412e+00 -7.077763464e-01 2.04 1.585777606e+01 -2.312606334e+00 6.309444679e+00 1.586548117e+01 1.587318628e+01 -1.739426880e+00 -1.484185046e+00 8.573044289e+00 -2.394626901e+00 -1.150797671e+00 2.06 1.181756897e+01 -2.572911329e+00 4.208305069e+00 1.182654833e+01 1.183552769e+01 -1.856505168e+00 -1.830135675e+00 6.000315599e+00 -2.487473847e+00 -1.507586939e+00 2.08 8.612726825e+00 -2.777256828e+00 2.555750373e+00 8.622093423e+00 8.631460022e+00 -1.959747748e+00 -2.106728516e+00 3.973195592e+00 -2.566704266e+00 -1.797181162e+00 2.10 6.073516227e+00 -2.938469182e+00 1.257021669e+00 6.082571439e+00 6.091626651e+00 -2.050172563e+00 -2.329558326e+00 2.377188167e+00 -2.633630924e+00 -2.034192859e+00 2.12 4.063690931e+00 -3.066210610e+00 2.367742542e-01 4.071576612e+00 4.079462292e+00 -2.128667006e+00 -2.510487497e+00 1.121111824e+00 -2.689366298e+00 -2.229804718e+00 2.14 2.474084915e+00 -3.167686626e+00 -5.647470699e-01 2.480363655e+00 2.486642395e+00 -2.196025678e+00 -2.658503004e+00 1.324104257e-01 -2.734807816e+00 -2.392544144e+00 2.16 1.217403166e+00 -3.248228373e+00 -1.194804100e+00 1.222012399e+00 1.226621632e+00 -2.252974720e+00 -2.780387697e+00 -6.460719199e-01 -2.770617006e+00 -2.528892698e+00 2.18 2.239894163e-01 -3.311845666e+00 -1.690678106e+00 2.270902068e-01 2.301909974e-01 -2.300096998e+00 -2.881211382e+00 -1.259507062e+00 -2.797444264e+00 -2.643764076e+00 2.20 -5.616095279e-01 -3.361356946e+00 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