{ "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" [ [ 0.8784497 0.4697805 1.02237 ] [ 0.3714623 2.027429 0.7033507 ] [ 0.1687176 1.823848 2.813644 ] [ 2.523837 0.1233038 2.780688 ] [ 2.720424 2.179791 0.2128499 ] [ 1.955613 2.373981 2.741889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.784497e-11 4.697805e-11 1.02237e-10 ] [ 3.714623e-11 2.027429e-10 7.033507e-11 ] [ 1.687176e-11 1.823848e-10 2.813644e-10 ] [ 2.523837e-10 1.233038e-11 2.780688e-10 ] [ 2.720424e-10 2.179791e-10 2.128499e-11 ] [ 1.955613e-10 2.373981e-10 2.741889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.3207886 -22.1762876 3.7235624 ] [ -6.5027373 21.7279066 -6.4217877 ] [ -10.5982702 -3.2122882 2.7884464 ] [ -0.3951552 0.2611056 -0.3595785 ] [ -0.7238155 -0.2378681 0.9772081 ] [ 10.8991895 3.6374317 -0.7078507 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.172919643737357e-08 -3.553032982158393e-08 5.965804672520962e-09 ] [ -1.041853375910025e-08 3.481194426025438e-08 -1.02888382014486e-08 ] [ -1.69803008752585e-08 -5.146653095713918e-09 4.467583667241418e-09 ] [ -6.331084282435967e-10 4.183372913265504e-10 -5.76108270788769e-10 ] [ -1.159680281427027e-09 -3.811067117939754e-10 1.565659984375535e-09 ] [ 1.746242674643814e-08 5.827808077510897e-09 -1.134101851900544e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1326541 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.46321250054243e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8180706 0.1627504 0.8389342 ] [ 0.4569876 2.557035 0.7875061 ] [ 0.1749984 1.3340771 2.8588548 ] [ 2.4158454 0.4423433 2.6374263 ] [ 2.6978378 1.6652975 0.5660781 ] [ 2.0547639 2.8366301 2.5859921 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.180706e-11 1.627504e-11 8.389342e-11 ] [ 4.569876e-11 2.557035e-10 7.875061e-11 ] [ 1.749984e-11 1.3340771e-10 2.8588548e-10 ] [ 2.4158454e-10 4.423433e-11 2.6374263e-10 ] [ 2.6978378e-10 1.6652975e-10 5.660781000000001e-11 ] [ 2.0547639e-10 2.8366301e-10 2.5859921e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 -1.7e-06 2.6e-06 ] [ -2.3e-06 -6e-07 -6e-06 ] [ -2.3e-06 7.2e-06 -6e-07 ] [ 5.5e-06 -2.2e-06 3.1e-06 ] [ 1.3e-06 2.7e-06 -1.05e-05 ] [ -1.8e-06 -5.4e-06 1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706536e-16 -2.7237002778e-15 4.165659248399999e-15 ] [ -3.685006258199999e-15 -9.613059803999998e-16 -9.613059803999999e-15 ] [ -3.685006258199999e-15 1.15356717648e-14 -9.613059803999998e-16 ] [ 8.811971486999999e-15 -3.5247885948e-15 4.9667475654e-15 ] [ 2.0828296242e-15 4.3258769118e-15 -1.6822854657e-14 ] [ -2.8839179412e-15 -8.6517538236e-15 1.81045959642e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.290227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.770199769595592e-18 } }