{ "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" [ [ 2.700341 1.969723 2.203994 ] [ 1.820171 2.226461 4.644887 ] [ 1.683397 4.142957 3.874532 ] [ 4.686676 2.237231 1.35428 ] [ 4.257123 2.593073 3.820407 ] [ 3.357584 4.187851 2.029918 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700341e-10 1.969723e-10 2.203994e-10 ] [ 1.820171e-10 2.226461e-10 4.644887e-10 ] [ 1.683397e-10 4.142957e-10 3.874532e-10 ] [ 4.686676000000001e-10 2.237231e-10 1.35428e-10 ] [ 4.257123e-10 2.593073e-10 3.820407e-10 ] [ 3.357584e-10 4.187851e-10 2.029918e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8576893 -1.8830462 0.1703139 ] [ 1.0235702 -3.6033705 0.9124334 ] [ -0.2544285 4.0559143 -1.6404386 ] [ 1.2890083 0.8150028 0.2127505 ] [ 0.4071751 0.1205741 0.0595027 ] [ 0.3923641 0.4949254 0.285438 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.578522985970318e-09 -3.016972597526281e-09 2.728729487772691e-10 ] [ 1.63994024418758e-09 -5.773235971180406e-09 1.461879461517055e-09 ] [ -4.076393943652129e-10 6.498291067428398e-09 -2.628272372777883e-09 ] [ 2.065218962277153e-09 1.305778432046538e-09 3.408638771635104e-10 ] [ 6.523664257919022e-10 1.931810040940013e-10 9.533383481447615e-11 ] [ 6.286365878612334e-10 7.929579049200885e-10 4.573220902879105e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8618562790819375 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.789552464034761e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.041045 2.0911003 2.1168401 ] [ 2.3810139 2.099883 4.4582286 ] [ 1.4384347 3.9710664 3.3798663 ] [ 4.4179631 2.1352025 1.6950729 ] [ 4.6257712 2.824767 3.9387218 ] [ 3.6010639 4.2352768 2.3392882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.041045e-10 2.0911003e-10 2.1168401e-10 ] [ 2.3810139e-10 2.099883e-10 4.4582286e-10 ] [ 1.4384347e-10 3.9710664e-10 3.3798663e-10 ] [ 4.4179631e-10 2.1352025e-10 1.6950729e-10 ] [ 4.6257712e-10 2.824767e-10 3.9387218e-10 ] [ 3.601063900000001e-10 4.2352768e-10 2.3392882e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-06 -2.6e-06 -4.4e-06 ] [ 9.7e-06 5.9e-06 -5e-07 ] [ 7.3e-06 -1.7e-06 -1.8e-06 ] [ -5.8e-06 3.3e-06 -2e-06 ] [ -4.5e-06 -9.2e-06 1.45e-05 ] [ -7.7e-06 4.3e-06 -5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-15 -4.16565921408e-15 -7.04957713152e-15 ] [ 1.554111322176e-14 9.45284206272e-15 -8.010883104e-16 ] [ 1.169588933184e-14 -2.72370025536e-15 -2.88391791744e-15 ] [ -9.292624400640001e-15 5.28718284864e-15 -3.2043532416e-15 ] [ -7.2097947936e-15 -1.474002491136e-14 2.32315610016e-14 ] [ -1.233675998016e-14 6.889359469440001e-15 -9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.6065442790819375 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.058485078822507e-18 } }