{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] "source-value" [ 5.59774 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] "source-value" [ -0.20689 5.51351 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] "source-value" [ 0.513105 0.215809 5.94806 ] } "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" [ [ 3.13853454427624e-09 7.133928526251879e-10 -1.018130434776978e-08 ] [ 1.011957023952309e-09 1.908716267127802e-10 -8.177671773054888e-09 ] [ 4.027563605691696e-09 1.725103477834984e-08 1.304220956153459e-09 ] [ 2.223024867889862e-10 -8.227422080830983e-10 1.988398919186669e-10 ] [ 3.584154656961151e-09 -4.439591522038942e-09 1.208292489507939e-08 ] [ -7.64274377204399e-09 -7.942494515376477e-09 1.146778904851333e-08 ] [ -3.70419309396239e-09 2.800949201131872e-10 -8.563457798747712e-09 ] [ -6.375756118816628e-10 -5.23056593230248e-09 1.868659127907546e-09 ] ] "source-value" [ [ 1.9589192 0.4452648 -6.3546704 ] [ 0.6316139 0.1191327 -5.1041013 ] [ 2.5138075 10.7672491 0.8140307 ] [ 0.1387503 -0.5135153 0.1241061 ] [ 2.2370534 -2.7709751 7.5415686 ] [ -4.7702255 -4.9573152 7.157631 ] [ -2.3119755 0.1748215 -5.34489 ] [ -0.3979434 -3.2646625 1.1663253 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.8790745173466e-18 "source-value" -24.211279 } }