{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 5.517305 2.823831 2.520754 ] [ 3.206819 2.056835 2.580452 ] [ 4.931014 5.152147 1.608787 ] [ 3.498861 3.411494 1.086096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.517305000000001e-10 2.823831e-10 2.520754e-10 ] [ 3.206819e-10 2.056835e-10 2.580452e-10 ] [ 4.931014e-10 5.152147000000001e-10 1.608787e-10 ] [ 3.498861e-10 3.411494e-10 1.086096e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6960956 0.8947021 -0.4737568 ] [ -0.135277 -2.2146262 2.6867696 ] [ 0.4201868 -0.7882863 0.5304726 ] [ 0.4111858 2.1082104 -2.7434853 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.115268096161748e-09 1.433470787200664e-09 -7.590420689050213e-10 ] [ -2.167376467319616e-10 -3.548222321451145e-09 4.304679438596168e-09 ] [ 6.732134673287655e-10 -1.262973880356935e-09 8.4991079769499e-10 ] [ 6.587922755649446e-10 3.377725414607416e-09 -4.395548007168475e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.335487 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.816145225678233e-18 } "relaxed-configuration-positions" { "source-value" [ [ 5.4526954 2.8370322 2.330131 ] [ 3.2319303 2.1313614 2.8141664 ] [ 4.8871787 5.0945659 1.8323446 ] [ 3.5821946 3.3813475 0.819447 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.452695399999999e-10 2.8370322e-10 2.330131e-10 ] [ 3.2319303e-10 2.1313614e-10 2.8141664e-10 ] [ 4.8871787e-10 5.0945659e-10 1.8323446e-10 ] [ 3.5821946e-10 3.3813475e-10 8.19447e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.8e-06 5e-06 1.2e-06 ] [ 1.34e-05 1.4e-05 -7.9e-06 ] [ -1.06e-05 -2.7e-05 -6e-07 ] [ 5e-06 7.9e-06 7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.249697764224e-14 8.010883104e-15 1.92261194496e-15 ] [ 2.146916671872e-14 2.24304726912e-14 -1.265719530432e-14 ] [ -1.698307218048e-14 -4.32587687616e-14 -9.6130597248e-16 ] [ 8.010883104e-15 1.265719530432e-14 1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.031003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927579173137467e-18 } }