{ "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" [ [ 1.248369 0.1750326 1.959235 ] [ 0.2041437 1.690187 0.8451771 ] [ 0.5672117 2.337944 2.235934 ] [ 2.305261 0.0188332 0.1900716 ] [ 2.629759 0.4646214 2.471997 ] [ 1.518408 2.931316 1.102854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.248369e-10 1.750326e-11 1.959235e-10 ] [ 2.041437e-11 1.690187e-10 8.451771e-11 ] [ 5.672117e-11 2.337944e-10 2.235934e-10 ] [ 2.305261e-10 1.88332e-12 1.900716e-11 ] [ 2.629759e-10 4.646214e-11 2.471997e-10 ] [ 1.518408e-10 2.931316e-10 1.102854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -37.3771739 -50.1873322 7.0585178 ] [ -45.7392428 -9.7798432 -47.5228666 ] [ -23.6260098 22.5600984 58.8096918 ] [ 12.6727256 -13.7377082 -24.5927916 ] [ 60.8540819 -6.6093698 35.5388406 ] [ 33.215619 57.7541549 -29.291392 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.988483417415596e-08 -8.040897031116303e-08 1.130899219666065e-08 ] [ -7.328234546725473e-08 -1.566903613012986e-08 -7.614002581991719e-08 ] [ -3.785304054435169e-08 3.614526221942749e-08 9.422351327841349e-08 ] [ 2.030394467813365e-08 -2.201023490141245e-08 -3.940199574172663e-08 ] [ 9.749898730042845e-08 -1.058937777178157e-08 5.693949953965785e-08 ] [ 5.321728820720027e-08 9.253235673484177e-08 -4.692998345308816e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 62.953545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.008626979954807e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.1393257 -0.1631985 1.2128962 ] [ 0.0736005 1.6277807 0.1225961 ] [ 1.8168153 3.0024186 3.2136861 ] [ 2.7343514 -1.1196948 -0.2263242 ] [ 2.2166601 0.6863695 3.1233173 ] [ 0.4923994 3.5842587 1.3590972 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1393257e-10 -1.631985e-11 1.2128962e-10 ] [ 7.36005e-12 1.6277807e-10 1.225961e-11 ] [ 1.8168153e-10 3.0024186e-10 3.2136861e-10 ] [ 2.7343514e-10 -1.1196948e-10 -2.263242e-11 ] [ 2.2166601e-10 6.863695e-11 3.1233173e-10 ] [ 4.923994e-11 3.5842587e-10 1.3590972e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.97e-05 1.31e-05 4e-07 ] [ 5.8e-06 6.9e-06 2e-07 ] [ 2.07e-05 6.7e-06 2.64e-05 ] [ 9.5e-06 -5.4e-06 -4.8e-06 ] [ 1.7e-06 -9e-07 -1.3e-06 ] [ -1.8e-05 -2.03e-05 -2.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.156287942976e-14 2.098851373248e-14 6.408706483200001e-16 ] [ 9.292624400640001e-15 1.105501868352e-14 3.2043532416e-16 ] [ 3.316505605055999e-14 1.073458335936e-14 4.229746278912e-14 ] [ 1.52206778976e-14 -8.65175375232e-15 -7.69044777984e-15 ] [ 2.72370025536e-15 -1.44195895872e-15 -2.08282960704e-15 ] [ -2.88391791744e-14 -3.252418540224e-14 -3.348549137472e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.00141 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.083055513943533e-18 } }