{ "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" [ [ 1.7024136 1.1492525 -3.7058049 ] [ 0.5943071 0.308155 -3.4721987 ] [ 1.2355532 6.2698358 -1.5157822 ] [ 0.1497054 -0.0389055 0.08306 ] [ 2.2425886 -1.6341046 3.6228391 ] [ -4.1513237 -2.9725315 5.540103 ] [ -1.142718 -0.3763029 -2.2078862 ] [ -0.6305263 -2.7053987 1.65567 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.727567268851963e-09 1.841305486895952e-09 -5.937353972026082e-09 ] [ 9.521849411954476e-10 4.93718736582624e-10 -5.563075579912152e-09 ] [ 1.979574450794627e-09 1.004538433501486e-08 -2.42855080306479e-09 ] [ 2.398544918875123e-10 -6.233348252053441e-11 1.33076790123648e-10 ] [ 3.593023024992603e-09 -2.618124186061736e-09 5.804428106940113e-09 ] [ -6.651153777512953e-09 -4.762520473891556e-09 8.876223503423942e-09 ] [ -1.830836063767334e-09 -6.029037087192403e-10 -3.537423651026953e-09 ] [ -1.010214496659527e-09 -4.334526547082713e-09 2.652675765759936e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.814795240654234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.892938871411532e-18 } }