{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.4751787 -17.3351563 -40.7552045 ] [ -17.279132 16.7457678 36.188411 ] [ -0.3556562 0.642338 0.506337 ] [ -0.1428584 -0.1269033 -0.6279479 ] [ 8.302468 0.0739539 4.6884043 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.518090979104214e-08 -2.777398214177383e-08 -6.529703582582295e-08 ] [ -2.768422131811715e-08 2.682967766650545e-08 5.798022604810155e-08 ] [ -5.698240486825689e-10 1.02913892625143e-09 8.112413036460097e-10 ] [ -2.288843885648947e-10 -2.033215003623686e-10 -1.006083444460456e-09 ] [ 1.330202012454013e-08 1.184872095969811e-10 7.51165175831819e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.5014971 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.405663549819e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9463018 2.2870488 0.0596198 ] [ -0.4499427 2.9816869 1.8249207 ] [ 1.7190003 0.1141027 0.3180973 ] [ 2.6139012 0.6366441 2.3830398 ] [ 1.8713146 2.8271709 2.1940079 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.463018e-11 2.2870488e-10 5.96198e-12 ] [ -4.499427e-11 2.9816869e-10 1.8249207e-10 ] [ 1.7190003e-10 1.141027e-11 3.180973e-11 ] [ 2.6139012e-10 6.366441e-11 2.3830398e-10 ] [ 1.8713146e-10 2.8271709e-10 2.1940079e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.61e-05 -1.08e-05 -1.91e-05 ] [ 2.5e-06 -1.07e-05 2.06e-05 ] [ -1.11e-05 1.3e-05 1.01e-05 ] [ -1.66e-05 2.68e-05 -9.9e-06 ] [ -9e-07 -1.84e-05 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.181680980288e-14 -1.730350750464e-14 -3.060157345728e-14 ] [ 4.005441552e-15 -1.714328984256e-14 3.300483838848e-14 ] [ -1.778416049088e-14 2.08282960704e-14 1.618198387008e-14 ] [ -2.659613190528e-14 4.293833343744e-14 -1.586154854592e-14 ] [ -1.44195895872e-15 -2.948004982272e-14 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.912293 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.06877739655195e-18 } }