{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0676993 1.1969839 -4.3338652 ] [ 3.4288554 -0.2586651 3.1458955 ] [ 0.7161805 0.9972142 -1.1946701 ] [ -1.1201689 -1.0893496 0.1564151 ] [ -1.1519318 3.2633871 -2.0475718 ] [ 0.9574195 -2.8632323 4.031876 ] [ -0.2885175 -0.676395 -1.2904709 ] [ 0.5258621 -0.5699433 1.5323914 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.914996138598156e-09 1.917779635854192e-09 -6.943617558345736e-09 ] [ 5.493632003244723e-09 -4.144271792512734e-10 5.040280263105747e-09 ] [ 1.147447662826437e-09 1.597713290333003e-09 -1.914072519558443e-09 ] [ -1.794708437713482e-09 -1.745330475377246e-09 2.506046184247734e-10 ] [ -1.845598213921561e-09 5.228522559317021e-09 -3.280571694397321e-09 ] [ 1.533955151835963e-09 -4.587403888774078e-09 6.459777518385383e-09 ] [ -4.62255997000095e-10 -1.08370426435443e-09 -2.067562322836951e-09 ] [ 8.425239693261713e-10 -9.131498379648521e-10 2.455161695222547e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.109535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.785385324160519e-18 } }