{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.368967 3.862197 2.346954 ] [ 2.915655 3.525719 0.4290147 ] [ 3.711297 1.607736 1.156277 ] [ 3.762397 3.78477 2.460668 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.368967e-10 3.862197e-10 2.346954e-10 ] [ 2.915655e-10 3.525719e-10 4.290147e-11 ] [ 3.711297e-10 1.607736e-10 1.156277e-10 ] [ 3.762397e-10 3.78477e-10 2.460668e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0959395 0.1830337 -0.0506645 ] [ -1.4450003 1.0634217 -2.2062095 ] [ 0.7551368 -1.2028202 0.5420071 ] [ 0.7858029 -0.0436352 1.7148669 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.53712025177643e-10 2.932523173745658e-10 -8.117347807329299e-11 ] [ -2.31514571678299e-09 1.703789399828557e-09 -3.534737310608823e-09 ] [ 1.209862536433531e-09 -1.927130419343207e-09 8.683911110821013e-10 ] [ 1.258995045309438e-09 -6.991129785991679e-11 2.747519677600014e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.5016026461517376 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.201889247721688e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8320398 4.2494311 2.0887123 ] [ 2.2567058 3.1536501 0.1453741 ] [ 4.0470348 2.1406731 1.1077869 ] [ 3.6225355 3.2366677 3.0510404 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8320398e-10 4.2494311e-10 2.0887123e-10 ] [ 2.2567058e-10 3.1536501e-10 1.453741e-11 ] [ 4.047034799999999e-10 2.1406731e-10 1.1077869e-10 ] [ 3.6225355e-10 3.2366677e-10 3.0510404e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.4e-06 -1.3e-06 -4.4e-06 ] [ -1.7e-06 -1.6e-06 8.1e-06 ] [ 8e-07 5e-06 -1.3e-06 ] [ -6.5e-06 -2.1e-06 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.18561070916e-14 -2.0828296242e-15 -7.0495771896e-15 ] [ -2.7237002778e-15 -2.5634826144e-15 1.29776307354e-14 ] [ 1.2817413072e-15 8.010883169999999e-15 -2.0828296242e-15 ] [ -1.0414148121e-14 -3.364570931399999e-15 -3.845223921599999e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }