{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46402e-10 0.0 0.0 ] "source-value" [ 5.46402 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] "source-value" [ 0.0122514 5.46447 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] "source-value" [ -0.0384841 0.0769758 5.42124 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.859749864034821e-09 5.514675907027392e-10 -7.445958831859162e-10 ] [ 1.578829062211054e-09 2.791554998733473e-09 1.979242640016459e-09 ] [ 2.458408165481708e-09 -1.345893730278129e-09 6.62808451700304e-10 ] [ -9.627689199524525e-10 1.897273521702048e-10 -4.554968105726641e-09 ] [ -1.710301112231309e-10 -8.851604457468729e-10 -1.160924522236376e-09 ] [ 2.60578934869352e-09 -8.401299900779923e-10 -2.182949944509117e-09 ] [ 4.74676867444416e-11 -9.48274348499399e-10 4.177867159059848e-09 ] [ -1.69694536792032e-09 4.867087332136377e-10 1.823520365099099e-09 ] ] "source-value" [ [ -2.4090664 0.344199 -0.4647402 ] [ 0.9854276 1.7423516 1.2353461 ] [ 1.5344177 -0.8400408 0.4136925 ] [ -0.6009131 0.1184185 -2.8429875 ] [ -0.1067486 -0.5524737 -0.7245921 ] [ 1.6264058 -0.5243679 -1.3624902 ] [ 0.029627 -0.5918663 2.6076196 ] [ -1.05915 0.3037797 1.1381519 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.629298826832666e-18 "source-value" -35.13532 } }