{ "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" [ [ -2.779737 -0.2244164 -0.1284725 ] [ -0.7949546 1.3136447 -0.3685143 ] [ 1.1291007 -1.2104612 -0.5242654 ] [ 2.1112183 -1.0659096 0.5403034 ] [ 0.3343726 1.1871424 0.4809488 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.453629633372729e-09 -3.595547094041011e-10 -2.05835635915728e-10 ] [ -1.273657674717416e-09 2.10469082637783e-09 -5.904249958904775e-10 ] [ 1.809018744068915e-09 -1.939372635025513e-09 -8.399657669743603e-10 ] [ 3.382544601665121e-09 -1.70777544100628e-09 8.656614756187508e-10 ] [ 5.357239623561101e-10 1.902011798840402e-09 7.70564923161815e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.1184236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.460932511047097e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2319497 2.2347053 2.7760772 ] [ 2.6373207 4.6187326 2.0000104 ] [ 4.4123403 2.7630395 1.3823264 ] [ 4.4729798 2.2427132 3.9710287 ] [ 4.8783925 4.6267044 3.1948783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2319497e-10 2.2347053e-10 2.7760772e-10 ] [ 2.6373207e-10 4.618732600000001e-10 2.0000104e-10 ] [ 4.4123403e-10 2.7630395e-10 1.3823264e-10 ] [ 4.4729798e-10 2.2427132e-10 3.9710287e-10 ] [ 4.8783925e-10 4.626704400000001e-10 3.1948783e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.91e-05 3.17e-05 1.62e-05 ] [ 1.23e-05 -2.43e-05 -3.4e-05 ] [ -2.18e-05 2.97e-05 2.82e-05 ] [ 1.3e-05 -1.76e-05 -1.64e-05 ] [ -2.26e-05 -1.96e-05 6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.060157345728e-14 5.078899887936e-14 2.595526125696e-14 ] [ 1.970677243584e-14 -3.893289188544e-14 -5.44740051072e-14 ] [ -3.492745033344e-14 4.758464563776e-14 4.518138070656001e-14 ] [ 2.08282960704e-14 -2.819830852608e-14 -2.627569658112e-14 ] [ -3.620919163008e-14 -3.140266176767999e-14 9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.338031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.656335157330565e-18 } }