{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5877545 -3.2600027 -3.9770897 ] [ -3.2750905 -3.2710858 2.3796716 ] [ -3.6361118 2.3055482 -1.3677641 ] [ 3.2400969 6.2356667 1.5891259 ] [ 2.0833509 -2.0101264 1.3760564 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.543863139469994e-09 -5.223100109684876e-09 -6.372000136164486e-09 ] [ -5.247273430104183e-09 -5.240857193390865e-09 3.81265420270173e-09 ] [ -5.825693316575006e-09 3.693895424167523e-09 -2.191399663789553e-09 ] [ 5.191207502306556e-09 9.990639401841088e-09 2.546060364487759e-09 ] [ 3.337896104902639e-09 -3.220577522932869e-09 2.204685392982213e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4214655 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.028832189537378e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4447369 1.7287838 0.9582828 ] [ 0.8475269 1.6338379 3.5584226 ] [ 0.8182811 3.202598 1.8053723 ] [ 2.691681 3.998444 2.9852232 ] [ 3.171012 1.7047813 3.1959102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4447369e-10 1.7287838e-10 9.582828e-11 ] [ 8.475269000000001e-11 1.6338379e-10 3.5584226e-10 ] [ 8.182811e-11 3.202598e-10 1.8053723e-10 ] [ 2.691681e-10 3.998444e-10 2.9852232e-10 ] [ 3.171012e-10 1.7047813e-10 3.1959102e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.63e-05 1.72e-05 1.3e-05 ] [ 6.9e-06 1.97e-05 -2.13e-05 ] [ 9.6e-06 -8.1e-06 6.9e-06 ] [ -1.8e-05 -2.35e-05 -1.19e-05 ] [ 1.78e-05 -5.2e-06 1.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.611547891904e-14 2.755743787776e-14 2.08282960704e-14 ] [ 1.105501868352e-14 3.156287942976e-14 -3.412636202304e-14 ] [ 1.538089555968e-14 -1.297763062848e-14 1.105501868352e-14 ] [ -2.88391791744e-14 -3.76511505888e-14 -1.906590178752e-14 ] [ 2.851874385024e-14 -8.33131842816e-15 2.114873139456e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }