{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6015794 -3.5920222 13.4237352 ] [ -18.1320893 -3.2074959 29.2939219 ] [ -13.0156719 -3.1834528 -22.8288164 ] [ -3.3469365 6.8475817 -1.3231073 ] [ 30.1921445 13.2485152 -10.7368001 ] [ 14.9041325 -10.1131259 -7.8289334 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.698560279817574e-08 -5.755054037649274e-09 2.150719487844332e-08 ] [ -2.905080980206141e-08 -5.138974984630801e-09 4.693403718640088e-08 ] [ -2.085340539399038e-08 -5.100453691601875e-09 -3.657579621795599e-08 ] [ -5.36238345578174e-09 1.0971035399146e-08 -2.119851600334828e-09 ] [ 4.837314844825161e-08 2.122646148863383e-08 -1.720225024414886e-08 ] [ 2.387905284154e-08 -1.620301401368022e-08 -1.254333416262217e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.420552 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.630862473178197e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2504293 -0.0373186 1.8979464 ] [ 0.1362863 1.5546379 3.3458723 ] [ 0.75839 1.4453198 -0.0324409 ] [ -0.1947155 3.1846914 1.4431413 ] [ 3.2147772 2.0714347 -0.0023816 ] [ 3.2318693 0.3825539 1.8339899 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2504293e-10 -3.73186e-12 1.8979464e-10 ] [ 1.362863e-11 1.5546379e-10 3.3458723e-10 ] [ 7.5839e-11 1.4453198e-10 -3.24409e-12 ] [ -1.947155e-11 3.1846914e-10 1.4431413e-10 ] [ 3.2147772e-10 2.0714347e-10 -2.3816e-13 ] [ 3.2318693e-10 3.825539e-11 1.8339899e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 -4.94e-05 -1.2e-06 ] [ -9.7e-06 2.6e-05 -1.9e-06 ] [ -2.07e-05 0.0 1.29e-05 ] [ -5e-06 2.22e-05 -1.8e-05 ] [ -6.1e-06 -8.8e-06 4.85e-05 ] [ 3.93e-05 1.01e-05 -4.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.364570931399999e-15 -7.91475257196e-14 -1.9226119608e-15 ] [ -1.55411133498e-14 4.165659248399999e-14 -3.0441356046e-15 ] [ -3.316505632379999e-14 0.0 2.06680785786e-14 ] [ -8.010883169999999e-15 3.55683212748e-14 -2.8839179412e-14 ] [ -9.773277467399999e-15 -1.40991543792e-14 7.770556674899999e-14 ] [ 6.29655417162e-14 1.61819840034e-14 -6.456771835019998e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.768929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.366243295300498e-18 } }