{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3731931 4.0655107 -1.0956568 ] [ -2.272823 1.2268188 -5.1585489 ] [ -0.5971499 1.1906072 2.3966267 ] [ -0.868716 0.3999376 -2.5512629 ] [ 4.0774816 -4.7789365 4.3735085 ] [ 0.5716934 -0.8359051 -2.8207884 ] [ 0.0889721 -1.0026437 3.8532135 ] [ -1.3726513 -0.265389 1.0029083 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.979212598638765e-10 6.513666195152243e-09 -1.755435709380541e-09 ] [ -3.641463873816518e-09 1.965580399317911e-09 -8.264906444833558e-09 ] [ -9.567396088930579e-10 1.90756302039615e-09 3.839819267525056e-09 ] [ -1.391836465314893e-09 6.407706724988621e-10 -4.087573771894408e-09 ] [ 6.532845691262176e-09 -7.65670033258778e-09 7.007133069570077e-09 ] [ 9.159537997456628e-10 -1.339267608427486e-09 -4.519401226703839e-09 ] [ 1.425490185234797e-10 -1.606412295132409e-09 6.173528584650941e-09 ] [ -2.199229821370727e-09 -4.252000512174912e-10 1.606836231066273e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.376436 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.347494544482747e-18 } }