{ "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" [ [ -1.460756 -1.7003439 -0.8319888 ] [ 0.1350924 0.9487131 1.1426225 ] [ -2.0998511 -2.4534797 -2.7102749 ] [ 0.2223761 4.7649749 -0.7656085 ] [ -1.1000958 -1.9926106 -0.6124496 ] [ 0.3864602 1.3122437 2.3786872 ] [ 2.1270603 -3.8324306 -0.3336953 ] [ 1.789714 2.952933 1.7327074 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.340389131175304e-09 -2.724251266344432e-09 -1.332993015109699e-09 ] [ 2.164418867109816e-10 1.520005961189705e-09 1.830683070982665e-09 ] [ -3.364332367299197e-09 -3.93090784733333e-09 -4.342339116496686e-09 ] [ 3.562857913800474e-10 7.634331446376487e-09 -1.226640049491789e-09 ] [ -1.762547785921537e-09 -3.19251414398072e-09 -9.812524386226463e-10 ] [ 6.191775024109667e-10 2.102446194253706e-09 3.811077051434884e-09 ] [ 3.40792631176903e-09 -6.140230758746599e-09 -5.346388125356201e-10 ] [ 2.867437952342676e-09 4.731120254367521e-09 2.776103309838891e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.251133 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.647854161462633e-18 } }