{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2775795 -1.3116535 1.1474282 ] [ -0.1208493 -0.7813248 0.1789696 ] [ 1.1093941 -3.3172543 0.7958462 ] [ 0.4301036 0.2187592 0.2349326 ] [ 0.4144351 0.9139117 -0.7287565 ] [ -1.1259046 1.1184918 -1.7764392 ] [ -1.3818734 1.1099266 0.35299 ] [ -1.602885 2.0491433 -0.2049708 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.649084626913354e-09 -2.101500572290493e-09 1.838382636086627e-09 ] [ -1.936219231000454e-10 -1.251820327811236e-09 2.867409089539277e-10 ] [ 1.777445290273457e-09 -5.314827284708271e-09 1.275086175392521e-09 ] [ 6.891019324419149e-10 3.504908758249113e-10 3.764035191837581e-10 ] [ 6.639982280589101e-10 1.464247959215583e-09 -1.167596626556035e-09 ] [ -1.803898027371176e-09 1.792021412516509e-09 -2.846169354512655e-09 ] [ -2.214005254385407e-09 1.778298449324033e-09 5.65552325376192e-10 ] [ -2.568104872831008e-09 3.28308948792896e-09 -3.283994237066727e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 159.78771 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.560081332531704e-17 } }