{ "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" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0596243 0.2287559 -0.3329139 ] [ 1.5822824 2.5990819 0.5751575 ] [ 2.1523192 -1.2715515 0.1285596 ] [ -0.3287863 0.1250354 -3.1554926 ] [ -0.3165319 -0.5710553 -0.9599503 ] [ 2.0383805 0.3232796 -2.115325 ] [ -1.170892 -1.6899839 3.949187 ] [ -0.8971476 0.256438 1.9107777 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.902058521891565e-09 3.665073548500628e-10 -5.333868673193491e-10 ] [ 2.535095868783314e-09 4.164188255724444e-09 9.21503899777776e-10 ] [ 3.44839550273896e-09 -2.037250085443171e-09 2.059751854993997e-10 ] [ -5.26773723099335e-10 2.003287946523763e-10 -5.055656470827406e-09 ] [ -5.071400099174035e-10 -9.149314508439304e-10 -1.538009927789947e-09 ] [ 3.265845581394615e-09 5.179510171015757e-10 -3.38912426039376e-09 ] [ -1.875975787881754e-09 -2.707652694108405e-09 6.327295082567289e-09 ] [ -1.43738891012683e-09 4.108589682847104e-10 3.061403358485996e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.214374 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.321529349730738e-18 } }