{ "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" [ [ 2.147227 2.362862 2.450911 ] [ 2.622761 1.752099 4.557796 ] [ 1.686581 4.667086 2.204349 ] [ 1.229897 3.438837 4.460251 ] [ 4.850673 1.640741 2.950795 ] [ 3.668046 3.670667 2.833872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.147227e-10 2.362862e-10 2.450911e-10 ] [ 2.622761e-10 1.752099e-10 4.557796e-10 ] [ 1.686581e-10 4.667086e-10 2.204349e-10 ] [ 1.229897e-10 3.438837e-10 4.460251000000001e-10 ] [ 4.850672999999999e-10 1.640741e-10 2.950795e-10 ] [ 3.668046e-10 3.670667e-10 2.833872e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3904429 -6.1516371 -4.7134878 ] [ 0.6726856 -1.8063805 1.2366981 ] [ 2.0199719 -0.018571 0.4826529 ] [ -2.196725 2.5698831 3.0145832 ] [ -3.984127 7.3887916 -0.3563192 ] [ 6.8786373 -1.9820862 0.3358728 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.432088348537352e-09 -9.856009141265912e-09 -7.551839955586027e-09 ] [ 1.077761141468821e-09 -2.894140605369014e-09 1.98140878280778e-09 ] [ 3.236351752852955e-09 -2.97540220248768e-11 7.732951923413203e-10 ] [ -3.51954143732688e-09 4.117406621009029e-09 4.829894724496451e-09 ] [ -6.383275133698042e-09 1.183814915748343e-08 -5.708862917821594e-10 ] [ 1.102079186502284e-08 -3.175652170050313e-09 5.381275477226343e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9690291 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.116561549369487e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8841468 2.7331874 2.4197067 ] [ 0.3373625 2.1750761 4.4758557 ] [ 2.7000734 3.3987208 1.3679728 ] [ 0.8141476 1.9853559 6.6157579 ] [ 6.608114 3.5159052 2.9498141 ] [ 4.8613406 3.7240467 1.6288667 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.841468000000001e-11 2.7331874e-10 2.4197067e-10 ] [ 3.373625e-11 2.1750761e-10 4.475855700000001e-10 ] [ 2.7000734e-10 3.3987208e-10 1.3679728e-10 ] [ 8.141476e-11 1.9853559e-10 6.615757900000001e-10 ] [ 6.608113999999999e-10 3.5159052e-10 2.9498141e-10 ] [ 4.8613406e-10 3.7240467e-10 1.6288667e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1615012 0.0742143 -0.1316253 ] [ -0.1356591 -0.0634387 0.2198542 ] [ -0.0509628 -0.0006515 -0.0704639 ] [ -0.0594881 -0.0235622 0.0076449 ] [ 0.1379361 0.0302319 -0.0056629 ] [ -0.0533273 -0.0167938 -0.0197469 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.58753446871145e-10 1.189044163890374e-10 -2.108869783657862e-10 ] [ -2.173498384187693e-10 -1.01640001993945e-10 3.522452592246874e-10 ] [ -8.165140669050625e-11 -1.0438180684512e-12 -1.128956131903891e-10 ] [ -9.531044303581248e-11 -3.775080597461376e-11 1.224848004835392e-11 ] [ 2.209979945843309e-10 4.843684338236352e-11 -9.07296598592832e-12 ] [ -8.543975331038784e-11 -2.690663373439104e-11 -3.163802151327552e-11 ] ] } "relaxed-potential-energy" { "source-value" -13.76261 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.205013198318829e-18 } }