{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2793347 -0.8581578 1.4018321 ] [ -3.3629423 6.8509517 -0.1005393 ] [ -8.9058166 -3.3777484 -6.8675817 ] [ 3.0348004 -6.7919441 -2.4282926 ] [ 2.1764146 -1.5175607 2.5487412 ] [ 10.0888537 6.3869418 -2.7716033 ] [ -1.7519751 -0.6924824 8.2174437 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.049720146518182e-09 -1.374920364117162e-09 2.245982616906968e-09 ] [ -5.38802753015938e-09 1.097643464397002e-08 -1.610817159315974e-10 ] [ -1.426869114565254e-08 -5.411749517424608e-09 -1.100307884117392e-08 ] [ 4.862286249674488e-09 -1.08818940468005e-08 -3.890553632181645e-09 ] [ 3.487000589287784e-09 -2.431400274184883e-09 4.083533563109736e-09 ] [ 1.616412552881158e-08 1.023300883037027e-08 -4.440598009392129e-09 ] [ -2.806973545443742e-09 -1.109479111595474e-09 1.316579617888025e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.547709 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.479703175601748e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7520234 2.2650147 3.5360699 ] [ 3.081806 5.2311103 2.4230707 ] [ 2.5211741 3.0597717 1.3705444 ] [ 4.6476757 1.9679399 1.5828434 ] [ 5.5017797 3.133736 3.4987207 ] [ 5.5104399 5.2776591 2.3514146 ] [ 3.3584042 3.7702592 4.5653092 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7520234e-10 2.2650147e-10 3.5360699e-10 ] [ 3.081806e-10 5.2311103e-10 2.4230707e-10 ] [ 2.5211741e-10 3.0597717e-10 1.3705444e-10 ] [ 4.6476757e-10 1.9679399e-10 1.5828434e-10 ] [ 5.5017797e-10 3.133736e-10 3.4987207e-10 ] [ 5.5104399e-10 5.2776591e-10 2.3514146e-10 ] [ 3.3584042e-10 3.7702592e-10 4.5653092e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.26e-05 -1.84e-05 2.53e-05 ] [ 1.88e-05 -9.3e-06 1.77e-05 ] [ 1.06e-05 -1.12e-05 -2.09e-05 ] [ 2.04e-05 7.4e-06 -4.05e-05 ] [ -4e-05 1.51e-05 -8.5e-06 ] [ -3.2e-06 -2.82e-05 1.21e-05 ] [ 6e-06 4.47e-05 1.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.018742542208e-14 -2.948004982272e-14 4.053506850624e-14 ] [ 3.012092047104e-14 -1.490024257344e-14 2.835852618816e-14 ] [ 1.698307218048e-14 -1.794437815296e-14 -3.348549137472e-14 ] [ 3.268440306432e-14 1.185610699392e-14 -6.488815314240001e-14 ] [ -6.4087064832e-14 2.419286697408e-14 -1.36185012768e-14 ] [ -5.126965186560001e-15 -4.518138070656001e-14 1.938633711168e-14 ] [ 9.6130597248e-15 7.161729494976001e-14 2.371221398784e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }