{ "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" [ 5.50751 0 0 ] "si-unit" "m" "si-value" [ 5.50751e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0552432 5.46365 0 ] "si-unit" "m" "si-value" [ 5.52432e-12 5.46365e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.041151 -0.173599 5.4807 ] "si-unit" "m" "si-value" [ -4.115100000000001e-12 -1.73599e-11 5.4807e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0203681 -0.0104771 -0.043973 ] [ 1.36957 1.30557 1.36025 ] [ 0.0138031 2.57027 2.84477 ] [ 1.29725 4.08516 4.13225 ] [ 2.77149 -0.00701058 2.61036 ] [ 3.98017 1.30013 4.07827 ] [ 2.6961 2.74296 0.249943 ] [ 4.17055 4.00651 1.44609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03681e-12 -1.04771e-12 -4.3973e-12 ] [ 1.36957e-10 1.30557e-10 1.36025e-10 ] [ 1.38031e-12 2.57027e-10 2.84477e-10 ] [ 1.29725e-10 4.08516e-10 4.13225e-10 ] [ 2.77149e-10 -7.01058e-13 2.61036e-10 ] [ 3.98017e-10 1.30013e-10 4.07827e-10 ] [ 2.6961e-10 2.74296e-10 2.49943e-11 ] [ 4.170550000000001e-10 4.00651e-10 1.44609e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2489398 1.0780271 1.1664607 ] [ -0.8197752 -0.1328315 0.4146901 ] [ -0.3002874 0.568284 -0.4291692 ] [ 2.2920948 -1.4772932 -0.9652104 ] [ -0.9188882 -0.815168 1.3056214 ] [ 0.7031445 -0.1643283 1.3004997 ] [ 0.0704536 0.5554484 -2.507587 ] [ 1.2221977 0.3878616 -0.2853053 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.603198769146628e-09 1.727189816208824e-09 1.868876062622003e-09 ] [ -1.313424659751644e-09 -2.128195238057952e-10 6.644067830972141e-10 ] [ -4.811134518008179e-10 9.104913387747072e-10 -6.876048586074394e-10 ] [ 3.672340701217252e-09 -2.366884627106819e-09 -1.546437537033016e-09 ] [ -1.472221191168995e-09 -1.306043111624294e-09 2.091836082696165e-09 ] [ 1.126561678944106e-09 -2.632829603958087e-10 2.083630214697414e-09 ] [ 1.128791107711949e-10 8.899264405407666e-10 -4.01759726602201e-09 ] [ 1.958176580935532e-09 6.214227876260812e-10 -4.571094814503302e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.97578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.763955363104423e-18 } }