{ "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" [ [ -1.1229364 -1.0758442 -0.4745869 ] [ 0.0335424 0.4363931 0.6912812 ] [ -1.4660684 -1.6444904 -1.8354947 ] [ 0.2142087 3.2245822 -0.7477893 ] [ -0.8178657 -1.2699636 -0.2599515 ] [ 0.1599633 0.7486342 1.812199 ] [ 1.6744771 -2.5782054 -0.3566255 ] [ 1.3246791 2.158894 1.1709677 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.799142446725317e-09 -1.723692424863279e-09 -7.603720357179475e-10 ] [ 5.374084908552192e-11 6.991788222984365e-10 1.107554577038569e-09 ] [ -2.348900514973663e-09 -2.63476407201004e-09 -2.94078669594231e-09 ] [ 3.43200171111961e-10 5.16635021268783e-09 -1.198090533744397e-09 ] [ -1.310365303494227e-09 -2.034705989187003e-09 -4.164882158418912e-10 ] [ 2.562894594460166e-10 1.199444212771311e-09 2.903462870037139e-09 ] [ 2.682808061684984e-09 -4.130740415500312e-09 -5.713770384811105e-10 ] [ 2.122369884082386e-09 3.458929493585396e-09 1.876097072651948e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.505759 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.688649697355919e-18 } }