{ "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" [ [ 1.239329 2.983674 3.512225 ] [ 2.999663 5.449943 1.062375 ] [ 1.178907 3.936124 1.554887 ] [ 2.122325 5.087093 3.38156 ] [ 3.136296 3.082629 1.288456 ] [ 5.117946 4.70791 1.219676 ] [ 3.839933 3.58316 3.463374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.239329e-10 2.983674e-10 3.512225e-10 ] [ 2.999663e-10 5.449943e-10 1.062375e-10 ] [ 1.178907e-10 3.936124e-10 1.554887e-10 ] [ 2.122325e-10 5.087093000000001e-10 3.38156e-10 ] [ 3.136296e-10 3.082629e-10 1.288456e-10 ] [ 5.117946e-10 4.70791e-10 1.219676e-10 ] [ 3.839933e-10 3.58316e-10 3.463374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9749943 -3.1532288 4.8157925 ] [ -1.7106936 2.5339774 -0.2311046 ] [ -5.3301077 2.2502106 -3.8521289 ] [ -0.1282067 3.9107186 0.7589492 ] [ 5.4891237 -3.0846554 -3.3921403 ] [ 0.0052191 -2.3171568 2.5731165 ] [ 2.6496595 -0.1398657 -0.6724845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.562113072873262e-09 -5.052029463393238e-09 7.715750154123983e-09 ] [ -2.740833291272187e-09 4.05987934791557e-09 -3.702703870793357e-10 ] [ -8.53977394328606e-09 3.60523481519634e-09 -6.171790863888022e-09 ] [ -2.054097773699194e-10 6.265661911447708e-09 1.215970664614863e-09 ] [ 8.794545660819193e-09 -4.942162765104472e-09 -5.434807883133498e-09 ] [ 8.361920001617281e-12 -3.712494451687741e-09 4.122587098894723e-09 ] [ 4.245222503980617e-09 -2.240895545918266e-10 -1.077438943750378e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.480519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.12112321028502e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5030344 2.9798135 3.6180757 ] [ 2.8133201 5.5390326 0.8258083 ] [ 0.9621038 4.0071742 1.4836841 ] [ 2.3125267 5.2384896 3.2271599 ] [ 3.2118328 3.0597968 1.0979227 ] [ 4.9043223 4.6884195 1.7246378 ] [ 3.9272589 3.3178067 3.5052644 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5030344e-10 2.9798135e-10 3.6180757e-10 ] [ 2.8133201e-10 5.5390326e-10 8.258083e-11 ] [ 9.621038e-11 4.0071742e-10 1.4836841e-10 ] [ 2.3125267e-10 5.2384896e-10 3.2271599e-10 ] [ 3.2118328e-10 3.0597968e-10 1.0979227e-10 ] [ 4.904322299999999e-10 4.6884195e-10 1.7246378e-10 ] [ 3.9272589e-10 3.317806700000001e-10 3.5052644e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.82e-05 -8.8e-06 7.32e-05 ] [ 1.21e-05 1.8e-05 1.9e-05 ] [ 1.35e-05 -5.5e-06 -2.36e-05 ] [ -6.54e-05 2.37e-05 5.25e-05 ] [ 1.79e-05 -4.2e-05 -7.97e-05 ] [ 5.11e-05 -1.79e-05 -2.51e-05 ] [ 1.9e-05 3.26e-05 -1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.722491312256001e-14 -1.409915426304e-14 1.1727932864256e-13 ] [ 1.938633711168e-14 2.88391791744e-14 3.04413557952e-14 ] [ 2.16293843808e-14 -8.8119714144e-15 -3.781136825088e-14 ] [ -1.0478235100032e-13 3.797158591296e-14 8.4114272592e-14 ] [ 2.867896151232001e-14 -6.72914180736e-14 -1.2769347667776e-13 ] [ 8.187122532288001e-14 -2.867896151232001e-14 -4.021463318208e-14 ] [ 3.04413557952e-14 5.223095783807999e-14 -2.627569658112e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.032609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.530013103502767e-18 } }