{ "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" [ [ -2.649266515955291e-09 -1.471646662757366e-08 7.987608830690872e-09 ] [ -2.954561994543476e-08 2.620142805994859e-08 -1.703700366873006e-08 ] [ 8.078360601335207e-09 -1.356500118640214e-08 -2.325128671106481e-08 ] [ 1.211507587314257e-08 2.161819655956478e-09 4.741127449623485e-09 ] [ 1.200144982669462e-08 -8.177990192926199e-11 2.755955409948052e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.764702 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.827364310373068e-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" [ [ 3.6048974265e-14 -6.8893595262e-15 -2.03476432518e-14 ] [ 2.49939554904e-14 1.42593720426e-14 -1.602176634e-16 ] [ -2.53143908172e-14 -2.899939707539999e-14 1.10550187746e-14 ] [ -2.53143908172e-14 4.838573434679999e-14 -3.476723295779999e-14 ] [ -1.02539304576e-14 -2.67563497878e-14 4.42200750984e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.025254 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.926658097671503e-18 } }