{ "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" [ [ 1.939068 2.794248 2.067966 ] [ 1.448231 2.940333 4.223978 ] [ 1.5948 5.060325 2.938211 ] [ 4.644526 2.195179 2.001544 ] [ 4.236112 3.084417 4.332379 ] [ 3.905251 4.388461 2.479334 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.939068e-10 2.794248e-10 2.067966e-10 ] [ 1.448231e-10 2.940333e-10 4.223978e-10 ] [ 1.5948e-10 5.060325e-10 2.938211e-10 ] [ 4.644526e-10 2.195179e-10 2.001544e-10 ] [ 4.236112000000001e-10 3.084417e-10 4.332379e-10 ] [ 3.905251e-10 4.388461e-10 2.479334e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1188754 -2.5560265 -4.1519479 ] [ 4.3032764 -0.1032307 3.9918718 ] [ -0.6992996 2.0084914 0.2198675 ] [ -2.1637303 -1.1530102 -0.5818928 ] [ -4.7486568 -1.5773877 2.1788992 ] [ 0.1895348 3.3811636 -1.6567978 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.996989249068249e-09 -4.095205900445251e-09 -6.652153856159657e-09 ] [ 6.894608840920388e-09 -1.653938140888185e-10 6.395683671190815e-09 ] [ -1.120401470054792e-09 3.217957964157861e-09 3.52266568173744e-10 ] [ -3.466678100376571e-09 -1.847325985983932e-09 -9.322950399718502e-10 ] [ -7.608186905162941e-09 -2.527253694877484e-09 3.490981357319824e-09 ] [ 3.036682253880039e-10 5.417221271019963e-09 -2.654482700552874e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.751718 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.882832783383454e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7717153 2.4109466 1.9021222 ] [ 1.7109368 2.9808979 4.3810963 ] [ 1.7557819 4.8434203 2.6482226 ] [ 4.2020895 2.4084368 1.9622868 ] [ 4.1413111 2.9783594 4.4412684 ] [ 4.1861534 4.840902 2.7084157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7717153e-10 2.4109466e-10 1.9021222e-10 ] [ 1.7109368e-10 2.9808979e-10 4.381096300000001e-10 ] [ 1.7557819e-10 4.843420300000001e-10 2.6482226e-10 ] [ 4.2020895e-10 2.4084368e-10 1.9622868e-10 ] [ 4.1413111e-10 2.9783594e-10 4.4412684e-10 ] [ 4.1861534e-10 4.840902e-10 2.7084157e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-06 1.04e-05 -7.1e-06 ] [ 1.1e-06 -8.8e-06 -5.2e-06 ] [ -1.54e-05 5.5e-06 1.59e-05 ] [ 4.3e-06 -1.13e-05 1.33e-05 ] [ -2.6e-06 1.18e-05 -5.8e-06 ] [ 8.6e-06 -7.5e-06 -1.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.24848882112e-15 1.666263685632e-14 -1.137545400768e-14 ] [ 1.76239428288e-15 -1.409915426304e-14 -8.33131842816e-15 ] [ -2.467351996032e-14 8.8119714144e-15 2.547460827072e-14 ] [ 6.889359469440001e-15 -1.810459581504e-14 2.130894905664e-14 ] [ -4.16565921408e-15 1.890568412544e-14 -9.292624400640001e-15 ] [ 1.377871893888e-14 -1.2016324656e-14 -1.778416049088e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.331035 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.296084922886653e-18 } }