{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.4940967 -9.5234394 -14.9380075 ] [ -6.3550429 -3.5320165 5.5076638 ] [ -7.8830376 17.3906377 18.2105216 ] [ 16.8066976 -17.3262834 4.330766 ] [ 7.9254797 12.9911016 -13.1109439 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.681339638915443e-08 -1.525823195628558e-08 -2.393332637783506e-08 ] [ -1.018190115856103e-08 -5.658914260579844e-09 8.824250175586488e-09 ] [ -1.263001854360734e-08 2.786287314374308e-08 2.917647196009341e-08 ] [ 2.692729796757547e-08 -2.775976618883514e-08 6.938652035355532e-09 ] [ 1.2698018283965e-08 2.081403926195748e-08 -2.100604779320038e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.917462 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.108299589167241e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9749567 -0.2263785 -0.2753597 ] [ 0.510781 0.1196198 3.5652752 ] [ 1.9679563 4.5714834 3.2630164 ] [ 1.2774255 0.842681 1.6296458 ] [ 2.1704698 2.8349844 1.9294639 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.749567000000001e-11 -2.263785e-11 -2.753597e-11 ] [ 5.107810000000001e-11 1.196198e-11 3.5652752e-10 ] [ 1.9679563e-10 4.5714834e-10 3.2630164e-10 ] [ 1.2774255e-10 8.42681e-11 1.6296458e-10 ] [ 2.1704698e-10 2.8349844e-10 1.9294639e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0829601 0.1244696 0.1634215 ] [ -0.1316901 -0.2568067 0.2027936 ] [ 0.1070407 0.1958699 0.0084418 ] [ -0.1197128 -0.3250099 -0.3515617 ] [ 0.0614022 0.2614771 -0.0230951 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.329167326792301e-10 1.994222831203277e-10 2.618301066360672e-10 ] [ -2.109907994108141e-10 -4.114496908047994e-10 3.249111647678668e-10 ] [ 1.714981070140665e-10 3.13818174498434e-10 1.352525459746944e-11 ] [ -1.918010493705062e-10 -5.207232633085459e-10 -5.632639365087033e-10 ] [ 9.837716930568575e-11 4.189324964945837e-10 -3.700242927503808e-11 ] ] } "relaxed-potential-energy" { "source-value" -10.156648 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.627274397129508e-18 } }