{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9701738 0.435353 0.8614305 ] [ 0.785215 2.880742 2.663197 ] [ 2.41347 1.4145 0.9828772 ] [ 2.657499 1.219941 2.828683 ] [ 1.63309 2.566255 0.271655 ] [ 2.657105 2.943765 2.654332 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.701738e-11 4.35353e-11 8.614305e-11 ] [ 7.85215e-11 2.880742e-10 2.663197e-10 ] [ 2.41347e-10 1.4145e-10 9.828772e-11 ] [ 2.657499e-10 1.219941e-10 2.828683e-10 ] [ 1.63309e-10 2.566255e-10 2.71655e-11 ] [ 2.657105e-10 2.943765e-10 2.654332e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.1975682 -16.7100122 -1.1112827 ] [ -20.106382 4.1014036 4.2187226 ] [ 48.024351 -27.5954806 0.7156192 ] [ 2.2763431 -28.4629176 19.5721196 ] [ -24.7291687 39.8571716 -22.5229578 ] [ 15.7324249 28.8098352 -0.8722209 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.396224846766144e-08 -2.677239110069493e-08 -1.780471175708432e-09 ] [ -3.221397543467819e-08 6.571173014523482e-09 6.759138775047729e-09 ] [ 7.694349303521453e-08 -4.421283422132029e-08 1.146548361081773e-09 ] [ 3.647103725787125e-09 -4.560262151418736e-08 3.135799270097342e-08 ] [ -3.962049626938415e-08 6.385822903484839e-08 -3.608575671572804e-08 ] [ 2.520612357093979e-08 4.615844478683071e-08 -1.397451945666451e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 16.085558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.577190517245177e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9320571 0.1981945 0.1927156 ] [ 0.8950886 3.0313636 2.7059394 ] [ 2.9102969 1.3358095 0.9960498 ] [ 2.281462 1.1419092 3.3567742 ] [ 0.7988777 2.5428888 0.4174336 ] [ 3.2987704 3.2103905 2.5932622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.320571e-11 1.981945e-11 1.927156e-11 ] [ 8.950886000000001e-11 3.0313636e-10 2.7059394e-10 ] [ 2.9102969e-10 1.3358095e-10 9.960498e-11 ] [ 2.281462e-10 1.1419092e-10 3.3567742e-10 ] [ 7.988777e-11 2.5428888e-10 4.174336e-11 ] [ 3.2987704e-10 3.2103905e-10 2.5932622e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.7e-06 6.2e-06 3.7e-06 ] [ -7.8e-06 -1.7e-05 -1.33e-05 ] [ -3.86e-05 -2.33e-05 1.49e-05 ] [ 2.45e-05 -2.26e-05 1.26e-05 ] [ 1.02e-05 2.61e-05 -1.37e-05 ] [ 4.1e-06 3.07e-05 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.23367600818e-14 9.9334951308e-15 5.9280535458e-15 ] [ -1.24969777452e-14 -2.723700277799999e-14 -2.13089492322e-14 ] [ -6.18440180724e-14 -3.733071557219999e-14 2.38724318466e-14 ] [ 3.925332753299999e-14 -3.62091919284e-14 2.01874255884e-14 ] [ 1.63422016668e-14 4.18168101474e-14 -2.19498198858e-14 ] [ 6.568924199399999e-15 4.91868226638e-14 -6.729141862799999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.962837 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.717746108775066e-18 } }