{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1428784 -2.350031 1.1718252 ] [ -1.6188159 1.6818141 -1.3161126 ] [ 1.8479326 -0.854505 -4.1504542 ] [ 1.2133186 -1.7066302 2.2021837 ] [ 2.7004431 3.2293522 2.0925578 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.63762291529731e-09 -3.765164726355245e-09 1.877470939104284e-09 ] [ -2.593628988359311e-09 2.694563231551793e-09 -2.108644838060302e-09 ] [ 2.960714408534158e-09 -1.369067933356704e-09 -6.649760684941168e-09 ] [ 1.943950694501787e-09 -2.734323006791228e-09 3.528287238846841e-09 ] [ 4.326586800620677e-09 5.173992595169046e-09 3.352647184832682e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.553043 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53056621520971e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0296816 2.4362693 3.3073908 ] [ 2.2901453 3.6960394 1.3219427 ] [ 4.5971872 4.1647078 1.0817237 ] [ 4.1155673 2.4099381 4.4230305 ] [ 5.6004016 3.7789404 3.1902333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0296816e-10 2.4362693e-10 3.3073908e-10 ] [ 2.2901453e-10 3.6960394e-10 1.3219427e-10 ] [ 4.5971872e-10 4.164707800000001e-10 1.0817237e-10 ] [ 4.1155673e-10 2.4099381e-10 4.423030500000001e-10 ] [ 5.6004016e-10 3.7789404e-10 3.1902333e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -1.2e-06 -1.1e-06 ] [ 1.3e-06 1.1e-06 9e-07 ] [ -1.9e-06 -0.0 -2e-06 ] [ -1e-07 1e-06 1.1e-06 ] [ 6e-07 -9e-07 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 -1.92261194496e-15 -1.76239428288e-15 ] [ 2.08282960704e-15 1.76239428288e-15 1.44195895872e-15 ] [ -3.04413557952e-15 0.0 -3.2043532416e-15 ] [ -1.6021766208e-16 1.6021766208e-15 1.76239428288e-15 ] [ 9.6130597248e-16 -1.44195895872e-15 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.976835 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.239335826977917e-18 } }