{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.398973 0.5934397 0.3006912 ] [ 0.7747556 0.9428375 2.620777 ] [ 1.097873 2.713389 1.114481 ] [ 2.795036 0.6708796 1.826441 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.398973e-10 5.934397e-11 3.006912e-11 ] [ 7.747556e-11 9.428375e-11 2.620777e-10 ] [ 1.097873e-10 2.713389e-10 1.114481e-10 ] [ 2.795036e-10 6.708796000000001e-11 1.826441e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0639131 -3.8875977 -9.8669686 ] [ -5.5396106 -0.8223767 6.1919102 ] [ -2.530984 7.9250804 -1.3767957 ] [ 12.1345076 -3.215106 5.0518542 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.511106557782853e-09 -6.228618146015853e-09 -1.580862640908771e-08 ] [ -8.87543459165586e-09 -1.317592722230655e-09 9.920533760533053e-09 ] [ -4.055083392418867e-09 1.269737853484031e-08 -2.20586988215797e-09 ] [ 1.944162438163992e-08 -5.151167666593805e-09 8.093962690930288e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.1852767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.899022617918975e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1188917 0.3514284 0.041816 ] [ 0.5420674 1.7632714 2.8531557 ] [ 0.1699855 3.0509112 1.5545306 ] [ 3.235693 -0.2450652 1.4128878 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1188917e-10 3.514284e-11 4.1816e-12 ] [ 5.420674e-11 1.7632714e-10 2.8531557e-10 ] [ 1.699855e-11 3.0509112e-10 1.5545306e-10 ] [ 3.235693e-10 -2.450652e-11 1.4128878e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -21.568291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.455621159081105e-18 } }