{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2222896 -0.1469311 1.0172992 ] [ 0.5104646 1.6168114 -0.4096682 ] [ -0.6497702 -1.729619 0.110438 ] [ -0.1383202 -0.1323264 -0.4825047 ] [ -0.9446637 0.392065 -0.2355643 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.958323820966984e-09 -2.354095732884269e-10 1.629892994598543e-09 ] [ 8.178544478660237e-10 2.590417425322917e-09 -6.563608123252185e-10 ] [ -1.04104662333254e-09 -2.771155124691475e-09 1.769411816479104e-10 ] [ -2.216133906243802e-10 -2.120102643946291e-10 -7.730577497661178e-10 ] [ -1.513518094658425e-09 6.28157376833952e-10 -3.774156141551174e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.957621775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.942985703329127e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4000819 2.7998408 0.7795825 ] [ 1.4370261 1.4005364 2.6720138 ] [ 2.5649175 4.4553207 1.9809395 ] [ 2.6018616 3.0560163 3.8733709 ] [ 3.5081569 2.2516638 1.7970086 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4000819e-10 2.7998408e-10 7.795824999999999e-11 ] [ 1.4370261e-10 1.4005364e-10 2.6720138e-10 ] [ 2.5649175e-10 4.4553207e-10 1.9809395e-10 ] [ 2.6018616e-10 3.0560163e-10 3.8733709e-10 ] [ 3.5081569e-10 2.2516638e-10 1.7970086e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-06 5e-07 -2.3e-06 ] [ -4e-07 -9e-07 1.4e-06 ] [ 2e-07 1.4e-06 3e-07 ] [ -2e-07 -0.0 7e-07 ] [ 2.2e-06 -9e-07 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-15 8.010883104e-16 -3.68500622784e-15 ] [ -6.408706483200001e-16 -1.44195895872e-15 2.24304726912e-15 ] [ 3.2043532416e-16 2.24304726912e-15 4.8065298624e-16 ] [ -3.2043532416e-16 0.0 1.12152363456e-15 ] [ 3.52478856576e-15 -1.44195895872e-15 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }