{ "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" [ [ 0.5485971 0.5343947 2.664941 ] [ 1.37313 2.35631 1.443365 ] [ 2.145447 0.6526892 0.5854964 ] [ 2.929696 0.0722677 2.986283 ] [ 2.995983 2.738917 0.2990299 ] [ 2.823077 2.78342 2.858653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.485971e-11 5.343947e-11 2.664941e-10 ] [ 1.37313e-10 2.35631e-10 1.443365e-10 ] [ 2.145447e-10 6.526892e-11 5.854964e-11 ] [ 2.929696e-10 7.22677e-12 2.986283e-10 ] [ 2.995983e-10 2.738917e-10 2.990299e-11 ] [ 2.823077e-10 2.78342e-10 2.858653e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3147657 -7.3424587 7.393019 ] [ -15.2268271 10.8901369 -2.1767082 ] [ 1.3806052 -13.9350007 -13.6351249 ] [ 8.9544715 -10.7991143 8.8982367 ] [ 10.9992849 10.3416217 -13.6220724 ] [ 8.2072312 10.844815 13.1426499 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.293478293676975e-08 -1.176391566832956e-08 1.18449221989302e-08 ] [ -2.439606638858387e-08 1.744792273849139e-08 -3.487470988343651e-09 ] [ 2.211973373994908e-09 -2.232633233237164e-08 -2.184587833646794e-08 ] [ 1.434664488891991e-08 -1.730208845680696e-08 1.425654680708454e-08 ] [ 1.762279711229847e-08 1.656910450889795e-08 -2.182496592612495e-08 ] [ 1.314943395014033e-08 1.737530904990115e-08 2.105684640513946e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 115.28343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.847044163116334e-17 } "relaxed-configuration-positions" { "source-value" [ [ -3.5379663 -2.1262636 5.3747384 ] [ -2.8742558 6.1691556 -0.1701244 ] [ 1.663757 -3.1462355 -3.3773197 ] [ 6.3687582 -3.5096861 5.4392123 ] [ 6.6662464 5.507938 -3.0927269 ] [ 4.5293907 6.2430903 6.6639886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.5379663e-10 -2.1262636e-10 5.3747384e-10 ] [ -2.8742558e-10 6.1691556e-10 -1.701244e-11 ] [ 1.663757e-10 -3.1462355e-10 -3.3773197e-10 ] [ 6.368758200000001e-10 -3.5096861e-10 5.4392123e-10 ] [ 6.6662464e-10 5.507938000000001e-10 -3.0927269e-10 ] [ 4.529390700000001e-10 6.243090300000001e-10 6.6639886e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 -0.0 -0.0 ] [ -0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }