{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.4726e-10 0.0 0.0 ] "source-value" [ 5.4726 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.8105e-12 5.560780000000001e-10 0.0 ] "source-value" [ 0.038105 5.56078 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.00683e-12 -7.32695e-12 5.55519e-10 ] "source-value" [ -0.0300683 -0.0732695 5.55519 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.110835954638187e-09 -2.920001658640672e-09 -7.769186749869217e-10 ] [ -5.753095809968641e-11 1.442046437563496e-09 1.817249125369964e-09 ] [ -2.517546266949719e-09 -3.140456515350551e-09 -3.822542195934659e-09 ] [ 1.657479592090802e-09 7.193707017715223e-09 -1.911880726171544e-09 ] [ -2.596143604565656e-09 -4.067556978282444e-09 9.649509242923201e-11 ] [ -5.282411566663258e-10 2.781973341670441e-09 5.086526088433346e-09 ] [ 3.967531009016292e-09 -6.179236659297865e-09 -2.343301548554615e-09 ] [ 3.185287500030142e-09 4.889525014622371e-09 1.854372999632859e-09 ] ] "source-value" [ [ -1.9416311 -1.8225217 -0.4849145 ] [ -0.035908 0.9000546 1.1342377 ] [ -1.5713288 -1.9601188 -2.3858432 ] [ 1.0345174 4.4899588 -1.1933021 ] [ -1.6203854 -2.5387694 0.0602275 ] [ -0.3297022 1.7363712 3.1747599 ] [ 2.4763381 -3.8567762 -1.4625738 ] [ 1.9881001 3.0518015 1.1574086 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.642991989539995e-18 "source-value" -35.220786 } }