{ "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" [ [ -2.0493939 -2.5275636 -1.3794926 ] [ 0.2870383 1.7871334 1.8555353 ] [ -3.067504 -4.3121433 -4.3161754 ] [ 0.2826888 8.4102656 -1.0317306 ] [ -2.0057871 -3.3002214 -1.2009847 ] [ 0.7420208 2.4865823 3.7922949 ] [ 2.9719396 -7.1421067 -0.2284533 ] [ 2.8389976 4.5980536 2.5090063 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.283491020442132e-09 -4.049603340868922e-09 -2.210190810495908e-09 ] [ 4.598860573230822e-10 2.863303375320976e-09 2.97289530122218e-09 ] [ -4.914683233501535e-09 -6.908815237719652e-09 -6.915275374125602e-09 ] [ 4.529173900534992e-10 1.347473103005399e-08 -1.6530146599028e-09 ] [ -3.213625224398621e-09 -5.287537614106767e-09 -1.9241896241315e-09 ] [ 1.188848387701987e-09 3.983944059577978e-09 6.075926278017366e-09 ] [ 4.761572184779306e-09 -1.144291647227485e-08 -3.660225392201922e-10 ] [ 4.548575618702078e-09 7.366894039799582e-09 4.019871268418794e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.413616 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.513669144664853e-18 } }