{ "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" [ [ -1.4880257 -1.5850731 -0.9836719 ] [ 0.3551813 0.858898 1.0306554 ] [ -2.7837104 -2.4197352 -3.3388207 ] [ -0.2421675 5.5454576 -1.2056499 ] [ -1.4456582 -2.000826 -0.7601062 ] [ 0.8959279 1.1989789 2.3525768 ] [ 2.4219203 -4.2235159 0.8865572 ] [ 2.2865323 2.6258158 2.0184595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.384080007331494e-09 -2.539567084001945e-09 -1.576016133702385e-09 ] [ 5.69063179693744e-10 1.376106306589332e-09 1.651291999585924e-09 ] [ -4.459995758702793e-09 -3.876843197907316e-09 -5.349380510655523e-09 ] [ -3.87995110014195e-10 8.884802591557717e-09 -1.931664098564437e-09 ] [ -2.316199788790499e-09 -3.205676665899683e-09 -1.21782439299853e-09 ] [ 1.435434747128688e-09 1.920975978239022e-09 3.76924357865049e-09 ] [ 3.88034411407027e-09 -6.76681848830748e-09 1.420421230544465e-09 ] [ 3.663428623946278e-09 4.207020719948016e-09 3.233928647575323e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.182895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.636921228547543e-18 } }