{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2600839 -3.975875 -0.0629345 ] [ 0.2593851 3.6562506 -0.3229244 ] [ 0.1816336 -1.1374303 0.4612751 ] [ -1.2809253 -2.5107383 -0.6806434 ] [ -0.1186485 -0.117501 -0.9059042 ] [ 0.5205792 3.3285693 0.7328166 ] [ 0.177892 0.7567247 0.7783149 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.167003440264851e-10 -6.3700539722232e-09 -1.008321845417376e-10 ] [ 4.155807430038701e-10 5.857959231105972e-09 -5.173819239658675e-10 ] [ 2.910091074717389e-10 -1.82236423444953e-09 7.390441809771821e-10 ] [ -2.052268568651226e-09 -4.022646205207136e-09 -1.090510942581823e-09 ] [ -1.900958527929888e-10 -1.882573551206208e-10 -1.451418529924528e-09 ] [ 8.340598235147675e-10 5.332955913172621e-09 1.174101623854145e-09 ] [ 2.850144034273536e-10 1.212406622721894e-09 1.24699793640029e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.716387158928928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.076083848227726e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6577017 2.3900771 3.4737457 ] [ 2.7367246 4.661187 2.6217031 ] [ 5.8716657 2.677433 1.0812856 ] [ 3.515006 2.805185 1.2032165 ] [ 4.9695378 1.8382548 3.139752 ] [ 5.0696531 4.7154715 2.0603242 ] [ 4.4300842 3.9218016 4.2644449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6577017e-10 2.3900771e-10 3.4737457e-10 ] [ 2.7367246e-10 4.661187e-10 2.6217031e-10 ] [ 5.871665700000001e-10 2.677433e-10 1.0812856e-10 ] [ 3.515006e-10 2.805185e-10 1.2032165e-10 ] [ 4.9695378e-10 1.8382548e-10 3.139752e-10 ] [ 5.069653100000001e-10 4.7154715e-10 2.0603242e-10 ] [ 4.4300842e-10 3.9218016e-10 4.2644449e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.4e-06 1.1e-06 -1.66e-05 ] [ 2.05e-05 -1.59e-05 3e-06 ] [ 3.25e-05 -3.2e-06 -1.32e-05 ] [ -4.23e-05 5e-07 1.65e-05 ] [ -7.6e-06 -3e-06 1.94e-05 ] [ -2.4e-06 2.15e-05 5.9e-06 ] [ -3.1e-06 -1e-06 -1.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.84522388992e-15 1.76239428288e-15 -2.659613190528e-14 ] [ 3.28446207264e-14 -2.547460827072e-14 4.8065298624e-15 ] [ 5.207074017599999e-14 -5.126965186560001e-15 -2.114873139456e-14 ] [ -6.777207105984e-14 8.010883104e-16 2.64359142432e-14 ] [ -1.217654231808e-14 -4.8065298624e-15 3.108222644352e-14 ] [ -3.84522388992e-15 3.44467973472e-14 9.45284206272e-15 ] [ -4.96674752448e-15 -1.6021766208e-15 -2.387243164992e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }