{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9127496 0.9873075 1.7461969 ] [ 0.2954063 -0.2402105 -0.6121151 ] [ -0.7779955 1.4901785 -0.0942506 ] [ -4.44109 1.4410028 -2.317234 ] [ 2.1940308 -2.3225954 1.7273594 ] [ 0.5411334 -3.1485858 -3.4172254 ] [ 1.2757653 1.7929029 2.9672688 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.462386081812846e-09 1.581841007072955e-09 2.797715871543234e-09 ] [ 4.732930713963941e-10 -3.848596503414569e-10 -9.807165105385732e-10 ] [ -1.246486211457147e-09 2.387529173189169e-09 -1.510061090604804e-10 ] [ -7.11541062749106e-09 2.308741015688575e-09 -3.712618170310356e-09 ] [ 3.515224882036327e-09 -3.721208080115883e-09 2.767534869200259e-09 ] [ 8.669912893569755e-10 -5.044590598904197e-09 -5.474998688991304e-09 ] [ 2.044001354128e-09 2.872547133410839e-09 4.754088738157219e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.231651005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.921032524068015e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0536856 3.0754688 1.2759188 ] [ 1.6548885 1.4344156 2.8307836 ] [ 1.1275104 3.1354729 4.4167846 ] [ 1.5476068 4.7076385 2.7976723 ] [ 3.4090483 2.4318662 4.1371917 ] [ 4.2426326 3.0422745 1.966655 ] [ 3.7152159 4.7433764 3.5525873 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0536856e-10 3.0754688e-10 1.2759188e-10 ] [ 1.6548885e-10 1.4344156e-10 2.8307836e-10 ] [ 1.1275104e-10 3.1354729e-10 4.4167846e-10 ] [ 1.5476068e-10 4.7076385e-10 2.7976723e-10 ] [ 3.4090483e-10 2.4318662e-10 4.1371917e-10 ] [ 4.2426326e-10 3.0422745e-10 1.966655e-10 ] [ 3.7152159e-10 4.7433764e-10 3.5525873e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.54e-05 -1.6e-05 -2.85e-05 ] [ 1.8e-06 7.4e-06 3.48e-05 ] [ 5.76e-05 -1.02e-05 -3.21e-05 ] [ 3.23e-05 -7.7e-06 -3.62e-05 ] [ -3.53e-05 -4.47e-05 2.21e-05 ] [ -2.47e-05 2.81e-05 -1.35e-05 ] [ 3.7e-06 4.31e-05 5.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.671705284359999e-14 -2.5634826144e-14 -4.5662034069e-14 ] [ 2.8839179412e-15 1.18561070916e-14 5.575574686319999e-14 ] [ 9.228537411839999e-14 -1.63422016668e-14 -5.14298699514e-14 ] [ 5.17503052782e-14 -1.23367600818e-14 -5.799879415079998e-14 ] [ -5.655683518019999e-14 -7.16172955398e-14 3.54081036114e-14 ] [ -3.95737628598e-14 4.50211634154e-14 -2.162938455899999e-14 ] [ 5.9280535458e-15 6.90538129254e-14 8.53960145922e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }