{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.478474 -1.7297905 -2.6625215 ] [ 0.9179776 -2.2800704 1.2391703 ] [ -1.4353158 3.9159718 -1.2454726 ] [ -0.0022764 -0.5406513 0.8714242 ] [ -1.2879494 0.1662112 -0.0137743 ] [ 0.6970404 -0.5420824 -1.5930343 ] [ 1.5889977 1.0104116 3.4042083 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.665998564606592e-10 -2.771429897981942e-09 -4.265829699677347e-09 ] [ 1.470762249138094e-09 -3.653075488658105e-09 1.985369683849723e-09 ] [ -2.299629418224849e-09 6.274078465672094e-09 -1.99546708156699e-09 ] [ -3.64719485958912e-12 -8.66218872865127e-10 1.396175480039343e-09 ] [ -2.063522417453388e-09 2.66299698755113e-10 -2.206886142788544e-11 ] [ 1.11678183263308e-09 -8.685117478271539e-10 -2.552322311592494e-09 ] [ 2.545854965444972e-09 1.618857842905121e-09 5.454142950593313e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.882015 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.627408919459491e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1790466 3.2232636 2.5354437 ] [ 4.6601459 1.0149759 2.0068011 ] [ 3.8737506 2.9001791 0.9024371 ] [ 3.5363306 1.8089204 3.8772861 ] [ 5.3373547 3.1464243 2.8654925 ] [ 3.841224 4.8948022 2.0972755 ] [ 3.5960907 4.1020435 4.2584033 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1790466e-10 3.2232636e-10 2.5354437e-10 ] [ 4.6601459e-10 1.0149759e-10 2.0068011e-10 ] [ 3.8737506e-10 2.9001791e-10 9.024371e-11 ] [ 3.5363306e-10 1.8089204e-10 3.8772861e-10 ] [ 5.337354699999999e-10 3.1464243e-10 2.8654925e-10 ] [ 3.841224e-10 4.8948022e-10 2.0972755e-10 ] [ 3.5960907e-10 4.1020435e-10 4.258403300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.87e-05 9.4e-06 1.47e-05 ] [ 3.64e-05 1.24e-05 -3.4e-06 ] [ -8.7e-06 -3.55e-05 -6.4e-06 ] [ -4.64e-05 6.7e-06 2.4e-06 ] [ 4.4e-06 -1.41e-05 -1.21e-05 ] [ -1.46e-05 2.95e-05 2.18e-05 ] [ 1.01e-05 -8.3e-06 -1.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.996070280896e-14 1.506046023552e-14 2.355199632576e-14 ] [ 5.831922899712e-14 1.986699009792e-14 -5.44740051072e-15 ] [ -1.393893660096e-14 -5.68772700384e-14 -1.025393037312e-14 ] [ -7.434099520512001e-14 1.073458335936e-14 3.84522388992e-15 ] [ 7.04957713152e-15 -2.259069035328e-14 -1.938633711168e-14 ] [ -2.339177866368e-14 4.72642103136e-14 3.492745033344e-14 ] [ 1.618198387008e-14 -1.329806595264e-14 -2.755743787776e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.380528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.867497168915979e-18 } }