{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.697876 3.711698 1.143091 ] [ 3.423522 2.241155 2.183353 ] [ 3.951754 3.941629 0.5726112 ] [ 3.96365 5.193256 2.218192 ] [ 5.084028 3.36384 3.521791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.697876e-10 3.711698e-10 1.143091e-10 ] [ 3.423522e-10 2.241155e-10 2.183353e-10 ] [ 3.951754000000001e-10 3.941629e-10 5.726112e-11 ] [ 3.96365e-10 5.193256e-10 2.218192e-10 ] [ 5.084028e-10 3.36384e-10 3.521791e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5397982 -0.2230025 -0.8468773 ] [ 0.0272886 -5.7495804 1.7328638 ] [ 1.7515692 -0.1416368 -5.6400513 ] [ 2.3799382 5.9860259 3.4650734 ] [ 0.3810022 0.1281938 1.2889915 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.273558539189923e-09 -3.57289391879952e-10 -1.356847010746228e-09 ] [ 4.372115693436288e-11 -9.211843296289913e-09 2.776353867390647e-09 ] [ 2.806323221953359e-09 -2.269271696049255e-10 -9.036358332972647e-09 ] [ 3.813081342988835e-09 9.590670748483278e-09 5.551659590835967e-09 ] [ 6.104328173133658e-10 2.05389109291511e-10 2.065192045709924e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6172009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.397571335516719e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1850256 2.921495 0.7984746 ] [ 3.0366668 1.9867881 2.7587462 ] [ 3.3222531 4.9186654 0.3988806 ] [ 4.876688 5.2183175 2.1122334 ] [ 4.7001965 3.406312 3.5707036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1850256e-10 2.921495e-10 7.984746000000001e-11 ] [ 3.0366668e-10 1.9867881e-10 2.7587462e-10 ] [ 3.3222531e-10 4.918665400000001e-10 3.988806e-11 ] [ 4.876688e-10 5.218317500000001e-10 2.1122334e-10 ] [ 4.7001965e-10 3.406312e-10 3.5707036e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.57e-05 5.2e-06 -2.77e-05 ] [ 1.21e-05 -6.7e-06 2.35e-05 ] [ -1.5e-05 0.0 -1.65e-05 ] [ 1.75e-05 9.2e-06 1.22e-05 ] [ 1.1e-06 -7.8e-06 8.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.515417294656e-14 8.33131842816e-15 -4.438029239616e-14 ] [ 1.938633711168e-14 -1.073458335936e-14 3.76511505888e-14 ] [ -2.4032649312e-14 0.0 -2.64359142432e-14 ] [ 2.8038090864e-14 1.474002491136e-14 1.954655477376e-14 ] [ 1.76239428288e-15 -1.249697764224e-14 1.377871893888e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }