{ "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" [ [ -2.2310153 1.1222503 1.2992221 ] [ -1.0065556 -0.0736536 0.5578504 ] [ -0.2620123 0.8213908 -0.5564246 ] [ 2.2385136 -1.704061 -0.9999505 ] [ -1.0532226 -0.9453658 1.8373949 ] [ 0.8598055 -0.2099963 1.458661 ] [ 0.2707691 0.4925356 -3.2166354 ] [ 1.1837176 0.4969 -0.380118 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.5744805837565e-09 1.79804320815949e-09 2.081583290996411e-09 ] [ -1.61267986314185e-09 -1.180060769299824e-10 8.937748761475535e-10 ] [ -4.197899848805981e-10 1.316013147142567e-09 -8.914904927027964e-10 ] [ 3.586494184811222e-09 -2.730206717110674e-09 -1.602097326256617e-09 ] [ -1.687448640120728e-09 -1.514642995342717e-09 2.943831176210766e-09 ] [ 1.377560281884687e-09 -3.364511650864542e-10 2.337032571127074e-09 ] [ 4.338199252292094e-10 7.891290297331703e-10 -5.153618077977243e-09 ] [ 1.896524679974558e-09 7.961215694345999e-10 -6.090161777628119e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.842847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.742657195943699e-18 } }