{ "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" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6535421 -9.185296 4.9854733 ] [ -18.4409255 16.3536451 -10.6336613 ] [ 5.0421161 -8.4666078 -14.5123117 ] [ 7.5616356 1.3493017 2.959179 ] [ 7.4907158 -0.051043 17.2013207 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.649266494128536e-09 -1.471646650632776e-08 7.987608764882624e-09 ] [ -2.954561970201455e-08 2.620142784408048e-08 -1.703700352836574e-08 ] [ 8.078360534779276e-09 -1.356500107464292e-08 -2.32512865195023e-08 ] [ 1.211507577332898e-08 2.161819638145696e-09 4.741127410562322e-09 ] [ 1.200144972781717e-08 -8.177990125549439e-11 2.755955387242309e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.764702 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.827364287079002e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1526465 0.5009789 1.6290469 ] [ -0.2846272 2.9255726 0.8286787 ] [ 2.0518459 0.4202587 -0.1307811 ] [ 2.292906 2.7361516 1.0045418 ] [ 1.9010947 1.5098765 3.2524421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.526465e-11 5.009789e-11 1.6290469e-10 ] [ -2.846272e-11 2.9255726e-10 8.286787e-11 ] [ 2.0518459e-10 4.202587e-11 -1.307811e-11 ] [ 2.292906e-10 2.7361516e-10 1.0045418e-10 ] [ 1.9010947e-10 1.5098765e-10 3.2524421e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.25e-05 -4.3e-06 -1.27e-05 ] [ 1.56e-05 8.9e-06 -1e-07 ] [ -1.58e-05 -1.81e-05 6.9e-06 ] [ -1.58e-05 3.02e-05 -2.17e-05 ] [ -6.4e-06 -1.67e-05 2.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.604897396800001e-14 -6.889359469440001e-15 -2.034764308416e-14 ] [ 2.499395528448e-14 1.425937192512e-14 -1.6021766208e-16 ] [ -2.531439060864e-14 -2.899939683648e-14 1.105501868352e-14 ] [ -2.531439060864e-14 4.838573394816e-14 -3.476723267136e-14 ] [ -1.025393037312e-14 -2.675634956736e-14 4.422007473408001e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658081798169e-18 } }