{ "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" [ [ 0.2245113 0.4062398 2.51204 ] [ 0.3734712 1.938106 1.147246 ] [ 0.9603572 2.15083 2.976354 ] [ 2.053947 0.3264748 1.110732 ] [ 2.246066 2.745531 0.3277405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.245113e-11 4.062398e-11 2.51204e-10 ] [ 3.734712e-11 1.938106e-10 1.147246e-10 ] [ 9.603572000000001e-11 2.15083e-10 2.976354000000001e-10 ] [ 2.053947e-10 3.264748e-11 1.110732e-10 ] [ 2.246066e-10 2.745531e-10 3.277405e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.5127114 -15.7012531 8.5747862 ] [ -13.1107755 6.949311 -11.7210677 ] [ 3.1800029 11.3941558 17.2885926 ] [ 11.0867253 -12.437951 -5.2562839 ] [ 9.3567587 9.7957373 -8.8860272 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.684322042629764e-08 -2.515618063408353e-08 1.373832197799848e-08 ] [ -2.100577798665743e-08 1.113402361486827e-08 -1.877922063975403e-08 ] [ 5.0949263004562e-09 1.825545003651272e-08 2.769937887025589e-08 ] [ 1.776289207689186e-08 -1.992779430285598e-08 -8.421495176867445e-09 ] [ 1.4991180035607e-08 1.569450128555852e-08 -1.423698503163288e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 89.458496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.433283108231303e-17 } "relaxed-configuration-positions" { "source-value" [ [ -3.0414057 -3.6971122 5.2420543 ] [ -3.9328245 3.4693068 -1.6762853 ] [ 1.9129933 4.8224271 6.9837098 ] [ 5.3025236 -3.4151633 -0.2624297 ] [ 5.617066 6.3877231 -2.2129366 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.0414057e-10 -3.6971122e-10 5.242054300000001e-10 ] [ -3.9328245e-10 3.4693068e-10 -1.6762853e-10 ] [ 1.9129933e-10 4.8224271e-10 6.9837098e-10 ] [ 5.3025236e-10 -3.4151633e-10 -2.624297e-11 ] [ 5.617066000000001e-10 6.3877231e-10 -2.2129366e-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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }