{ "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" [ 5.4726 0 0 ] "si-unit" "m" "si-value" [ 5.4726e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038105 5.56078 0 ] "si-unit" "m" "si-value" [ 3.8105e-12 5.560780000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0300683 -0.0732695 5.55519 ] "si-unit" "m" "si-value" [ -3.00683e-12 -7.32695e-12 5.55519e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0119551 0.065874 -0.0174062 ] [ 1.35048 1.36142 1.35358 ] [ 0.0629681 2.82177 2.8468 ] [ 1.33242 4.00392 4.21267 ] [ 2.75302 -0.0155517 2.72 ] [ 4.0777 1.32793 4.00537 ] [ 2.56601 2.8685 0.00815077 ] [ 4.04738 3.99965 1.27482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.19551e-12 6.587400000000001e-12 -1.74062e-12 ] [ 1.35048e-10 1.36142e-10 1.35358e-10 ] [ 6.296810000000001e-12 2.82177e-10 2.8468e-10 ] [ 1.33242e-10 4.00392e-10 4.21267e-10 ] [ 2.75302e-10 -1.55517e-12 2.72e-10 ] [ 4.0777e-10 1.32793e-10 4.00537e-10 ] [ 2.56601e-10 2.8685e-10 8.15077e-13 ] [ 4.047380000000001e-10 3.99965e-10 1.27482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1684642 -1.0911228 -0.4709551 ] [ -0.0243241 0.4543048 0.6264748 ] [ -1.6856944 -1.9897837 -2.1195003 ] [ 0.0421865 3.6136067 -0.9243218 ] [ -0.9026787 -1.1094401 -0.2704966 ] [ 0.2588103 0.6033621 1.8988711 ] [ 1.9912478 -2.8149117 -0.1647829 ] [ 1.4889169 2.3339848 1.4247108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.872086023481776e-09 -1.748171440581834e-09 -7.545532506665262e-10 ] [ -3.897150434200128e-11 7.278765292772199e-10 1.003723278080356e-09 ] [ -2.700780157493484e-09 -3.187984924588921e-09 -3.395813828438586e-09 ] [ 6.75902240133792e-11 5.789636171506239e-09 -1.480926778055773e-09 ] [ -1.446250709234137e-09 -1.777518990398014e-09 -4.333833285258892e-10 ] [ 4.146598118822343e-10 9.666926504967918e-10 3.042326882332779e-09 ] [ 3.190330671379434e-09 -4.509985715356384e-09 -2.640113098876243e-10 ] [ 2.385507847494011e-09 3.739455879862564e-09 2.282638335161264e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.426747 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.675990579439654e-18 } }