{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.2156475e-10 2.27441e-10 1.777219e-10 ] [ 1.5882354e-10 3.3343502e-10 4.4959999e-10 ] [ 1.855908e-10 4.964226e-11 4.3145276e-10 ] [ 4.106176900000001e-10 -1.318279e-11 2.3857024e-10 ] [ 5.178339000000001e-10 2.3304153e-10 1.4153046e-10 ] [ 4.5918625e-10 1.1361054e-10 4.9181175e-10 ] [ 4.3188368e-10 3.618934e-10 3.789481e-10 ] ] "source-value" [ [ 2.2156475 2.27441 1.777219 ] [ 1.5882354 3.3343502 4.4959999 ] [ 1.855908 0.4964226 4.3145276 ] [ 4.1061769 -0.1318279 2.3857024 ] [ 5.178339 2.3304153 1.4153046 ] [ 4.5918625 1.1361054 4.9181175 ] [ 4.3188368 3.618934 3.789481 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.47222839983168e-12 1.417926309408e-12 1.57670201252928e-12 ] [ 3.4334644983744e-13 -5.6965389752544e-12 -1.62476731115328e-12 ] [ 5.181118756343041e-12 4.32315317590464e-12 7.6471890110784e-13 ] [ -4.530955483622399e-12 -1.09252423772352e-12 3.21492760729728e-12 ] [ -5.72730076637376e-12 2.89176858288192e-12 2.46126372487296e-12 ] [ -3.70086777638592e-12 -3.3517534907136e-13 -3.60778131471744e-12 ] [ -1.03756957963008e-12 -1.5084492884832e-12 -2.78522383759872e-12 ] ] "source-value" [ [ 0.0059121 0.000885 0.0009841 ] [ 0.0002143 -0.0035555 -0.0010141 ] [ 0.0032338 0.0026983 0.0004773 ] [ -0.002828 -0.0006819 0.0020066 ] [ -0.0035747 0.0018049 0.0015362 ] [ -0.0023099 -0.0002092 -0.0022518 ] [ -0.0006476 -0.0009415 -0.0017384 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.018665777779143e-18 "source-value" -18.84103 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.241111603016481e-08 1.782351635739333e-09 -1.75030959334759e-08 ] [ -4.672114101230818e-08 7.18316536846454e-08 3.262901742071556e-09 ] [ -2.204229077058843e-08 -4.527465654550506e-08 -1.73395484677249e-09 ] [ 1.265341368684193e-08 -1.471303384291769e-08 -1.4370091942677e-08 ] [ 3.638151453761845e-08 -8.07687115139258e-09 -1.038833729027424e-08 ] [ 6.35222802696605e-08 -1.842996552275674e-08 1.427753548103469e-08 ] [ 8.61733931894054e-09 1.2880521902405e-08 2.645504279009339e-08 ] ] "source-value" [ [ -32.7124459 1.1124564 -10.9245733 ] [ -29.1610428 44.8337922 2.0365431 ] [ -13.7577159 -28.2582182 -1.0822495 ] [ 7.8976397 -9.1831535 -8.969106 ] [ 22.7075555 -5.0411865 -6.4838902 ] [ 39.6474892 -11.5030798 8.9113368 ] [ 5.3785202 8.0393895 16.5119391 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.601246621358691e-18 "source-value" 9.9941954 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] "source-value" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] } "instance-id" 1 }