{ "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" [ [ -2.0832574 0.9623021 1.0414977 ] [ -0.6958836 -0.1142834 0.4863917 ] [ -0.3175566 0.637385 -0.547165 ] [ 2.2162111 -1.3874497 -0.763598 ] [ -1.0407833 -0.8251047 1.3981293 ] [ 0.7613276 -0.2445191 1.2907664 ] [ 0.0019951 0.5699952 -2.6079927 ] [ 1.157947 0.4016745 -0.2980295 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.337746301388594e-09 1.541777926766744e-09 1.668663265556972e-09 ] [ -1.114928434718139e-09 -1.831021916255347e-10 7.792854102911673e-10 ] [ -5.087817603007373e-10 1.021203345448608e-09 -8.766549707200321e-10 ] [ 3.550761611177451e-09 -2.222939471875974e-09 -1.223418863289639e-09 ] [ -1.667518670579073e-09 -1.321963460052198e-09 2.24005007731547e-09 ] [ 1.219781281489774e-09 -3.917627853590573e-10 2.068035748994181e-09 ] [ 3.19650257615808e-12 9.132329834082203e-10 -4.178464931157068e-09 ] [ 1.855235611525498e-09 6.435534930715296e-10 -4.774958972087137e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.270163 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.048726436240519e-18 } }