{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.911203 -2.7534095 2.2741171 ] [ -3.4128704 1.1466247 2.8433961 ] [ 1.2943462 4.7775548 -0.7645115 ] [ 1.7505297 0.2466428 -1.0516063 ] [ -1.4190252 -4.3883988 -2.0484578 ] [ -0.941363 -1.2920523 -0.7024818 ] [ -0.1828202 2.2630383 -0.5504558 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.664261423430702e-09 -4.411448364733622e-09 3.643537280599841e-09 ] [ -5.468021209750233e-09 1.83709530230726e-09 4.555622792626727e-09 ] [ 2.073771237946691e-09 7.654486668214543e-09 -1.224882461724291e-09 ] [ 2.80465778246303e-09 3.951653311043352e-10 -1.684859042027194e-09 ] [ -2.273529018497176e-09 -7.030990018033639e-09 -3.281991222895045e-09 ] [ -1.508229802712142e-09 -2.070096004965958e-09 -1.125499925770261e-09 ] [ -2.929102526632068e-10 3.625787086107082e-09 -8.819274208097772e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.062579 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.534814855957909e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.634874 1.3129228 2.589978 ] [ 1.7882213 2.7337683 4.3764567 ] [ 2.5394998 3.8436454 2.1908979 ] [ 4.5828705 2.4043884 1.6198507 ] [ 4.3241277 2.4180564 4.1704896 ] [ 4.9401403 4.4998007 2.8067531 ] [ 3.2129564 4.7033651 4.5104351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.634874e-10 1.3129228e-10 2.589978e-10 ] [ 1.7882213e-10 2.7337683e-10 4.3764567e-10 ] [ 2.539499800000001e-10 3.8436454e-10 2.1908979e-10 ] [ 4.582870500000001e-10 2.404388400000001e-10 1.6198507e-10 ] [ 4.3241277e-10 2.4180564e-10 4.1704896e-10 ] [ 4.940140300000001e-10 4.4998007e-10 2.8067531e-10 ] [ 3.2129564e-10 4.7033651e-10 4.5104351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.36e-05 3.82e-05 3e-06 ] [ 2.63e-05 6.5e-06 -1.79e-05 ] [ 1.3e-06 -6.1e-05 3.11e-05 ] [ -2.06e-05 4.7e-06 -2.3e-05 ] [ -4.01e-05 -1.33e-05 1.06e-05 ] [ 2.85e-05 1.9e-05 5.3e-06 ] [ -9e-06 6e-06 -9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.17896022224e-14 6.12031474188e-14 4.806529901999999e-15 ] [ 4.21372454742e-14 1.0414148121e-14 -2.86789617486e-14 ] [ 2.0828296242e-15 -9.773277467399998e-14 4.982769331739999e-14 ] [ -3.300483866039999e-14 7.530230179799999e-15 -3.6850062582e-14 ] [ -6.42472830234e-14 -2.13089492322e-14 1.69830723204e-14 ] [ 4.5662034069e-14 3.0441356046e-14 8.4915361602e-15 ] [ -1.4419589706e-14 9.613059803999999e-15 -1.45798073694e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937497194045e-18 } }