{ "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" [ [ 0.8494568 1.09498 0.2360667 ] [ 0.557157 2.835915 1.114432 ] [ 0.135541 1.869398 2.917972 ] [ 1.620291 0.3348641 1.837353 ] [ 2.814436 1.836887 0.4161362 ] [ 2.451507 2.913738 2.050042 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.494568e-11 1.09498e-10 2.360667e-11 ] [ 5.57157e-11 2.835915e-10 1.114432e-10 ] [ 1.35541e-11 1.869398e-10 2.917972e-10 ] [ 1.620291e-10 3.348641e-11 1.837353e-10 ] [ 2.814436e-10 1.836887e-10 4.161362e-11 ] [ 2.451507e-10 2.913738e-10 2.050042e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6899766 -2.8202646 -2.5811978 ] [ -8.3865283 -2.7224805 3.1133142 ] [ 0.1797976 -0.0846262 -0.8286113 ] [ -3.0293602 9.178433 6.2735992 ] [ 22.8089767 2.5227433 -11.4934442 ] [ -0.8829092 -6.0738049 5.5163399 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.712723072652676e-08 -4.518562043817355e-09 -4.135534802892204e-09 ] [ -1.343669968263974e-08 -4.361894643620637e-09 4.988079265540402e-09 ] [ 2.880675135692784e-10 -1.355861202642108e-10 -1.327581663528364e-09 ] [ -4.853570128409567e-09 1.470547088933452e-08 1.005141404932109e-08 ] [ 3.654400951419042e-08 4.041880368840052e-09 -1.841452774142282e-08 ] [ -1.414576490183632e-09 -9.731308290254704e-09 8.838150892981895e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2003995 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.474066510236528e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4846541 0.7708361 -0.0126425 ] [ 0.6528735 3.1336788 0.8379585 ] [ 0.1171075 1.8928128 2.9611733 ] [ 1.9037646 0.384411 2.0298209 ] [ 2.7791513 1.9119637 0.2114739 ] [ 2.4908379 2.7920796 2.5442178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.846541e-11 7.708361000000001e-11 -1.26425e-12 ] [ 6.528735e-11 3.1336788e-10 8.379585e-11 ] [ 1.171075e-11 1.8928128e-10 2.9611733e-10 ] [ 1.9037646e-10 3.84411e-11 2.0298209e-10 ] [ 2.7791513e-10 1.9119637e-10 2.114739e-11 ] [ 2.4908379e-10 2.7920796e-10 2.5442178e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.79e-05 4.88e-05 4.34e-05 ] [ 7.69e-05 -6.34e-05 4.5e-06 ] [ 7.89e-05 2.59e-05 -6e-07 ] [ -3.14e-05 4.15e-05 -1.24e-05 ] [ -9.52e-05 1.48e-05 6.7e-06 ] [ -0.0001171 -6.76e-05 -4.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.408313261286e-13 7.818621973919999e-14 6.953446591559999e-14 ] [ 1.232073831546e-13 -1.015779985956e-13 7.209794853e-15 ] [ 1.264117364226e-13 4.149637482059999e-14 -9.613059803999998e-16 ] [ -5.030834630759999e-14 6.649033031099999e-14 -1.98669902616e-14 ] [ -1.525272155568e-13 2.37122141832e-14 1.07345834478e-14 ] [ -1.876148838414e-13 -1.083071404584e-13 -6.665054797439999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.071805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536293024120437e-18 } }