{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1327523 1.1203893 -4.5097212 ] [ 0.4246611 0.3418842 -2.843215 ] [ 1.110519 6.4932866 -0.261069 ] [ 0.2157393 -0.6148356 0.4423124 ] [ 1.7927548 -1.0811464 4.5045192 ] [ -3.0309399 -2.9750356 5.4972377 ] [ -1.8600073 -0.4890139 -4.2395738 ] [ 0.2145207 -2.7955286 1.4095097 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.814869267169758e-09 1.795061557443616e-09 -7.225369932494441e-09 ] [ 6.803820917887373e-10 5.477588767737828e-10 -4.555332638438309e-09 ] [ 1.779247593413046e-09 1.04033920683853e-08 -4.18278651661746e-10 ] [ 3.456524654955161e-10 -9.850752320713704e-10 7.086625922084616e-10 ] [ 2.872309851051343e-09 -1.732187500013217e-09 7.217035409644372e-09 ] [ -4.856101086838296e-09 -4.76653252363817e-09 8.807545794483902e-09 ] [ -2.980060235129428e-09 -7.834866442812125e-10 -6.792546080478588e-09 ] [ 3.437000530493238e-10 -4.478930602598732e-09 2.25828350673635e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.65858329230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.271175924647142e-18 } }