{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9117524 -1.7870196 -0.5748619 ] [ -3.7319683 -0.6206953 1.8636385 ] [ -0.2530071 2.4414051 -1.7139002 ] [ 1.3149183 0.0791389 -0.0114882 ] [ 0.7583046 -0.1128291 0.4366118 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.062965025273421e-09 -2.863121047620026e-09 -9.210303039568446e-10 ] [ -5.979272409088703e-09 -9.9446350649362e-10 2.985878058922809e-09 ] [ -4.053620638561014e-10 3.911562205348432e-09 -2.745970853447927e-09 ] [ 2.106731375879002e-09 1.267944964204626e-10 -1.84061256067188e-11 ] [ 1.214937911574716e-09 -1.807721476552494e-10 6.995292240886811e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.425325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.990756538485605e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1711608 0.7835281 2.26806 ] [ 1.1749679 1.9328835 3.0660047 ] [ 1.6899655 3.921103 1.9798913 ] [ 3.2036463 1.9492892 4.4175821 ] [ 3.8363395 3.1261442 2.378648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1711608e-10 7.835281e-11 2.26806e-10 ] [ 1.1749679e-10 1.9328835e-10 3.0660047e-10 ] [ 1.6899655e-10 3.921103e-10 1.9798913e-10 ] [ 3.2036463e-10 1.9492892e-10 4.4175821e-10 ] [ 3.8363395e-10 3.1261442e-10 2.378648e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.73e-05 -1.38e-05 3.39e-05 ] [ 1.1e-05 -7.8e-06 1.31e-05 ] [ -2.3e-06 4.13e-05 2.1e-05 ] [ -3.75e-05 -6e-07 -4.83e-05 ] [ -8.5e-06 -1.9e-05 -1.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.97611884482e-14 -2.21100375492e-14 5.431378789259999e-14 ] [ 1.7623942974e-14 -1.24969777452e-14 2.09885139054e-14 ] [ -3.685006258199999e-15 6.61698949842e-14 3.364570931399999e-14 ] [ -6.008162377499999e-14 -9.613059803999998e-16 -7.73851314222e-14 ] [ -1.3618501389e-14 -3.0441356046e-14 -3.17230973532e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.004913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.243834436980284e-18 } }