{ "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" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.0718253 0.0473088 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.18253e-12 4.73088e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6136092 -0.9471491 -0.2029753 ] [ -0.4634558 -1.7560409 -0.7987843 ] [ 16.880021 -25.8830189 18.2721967 ] [ -1.1940128 -3.0413959 -32.2584574 ] [ -15.8361617 31.6276047 14.9880203 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.831103145477913e-10 -1.517500144431761e-09 -3.252022802598663e-10 ] [ -7.425380475341606e-10 -2.813487675148591e-09 -1.279793530522093e-09 ] [ 2.704477500481304e-08 -4.146916775730454e-08 2.927528636339891e-08 ] [ -1.913019393095946e-09 -4.872853405576975e-09 -5.168374626935274e-08 ] [ -2.537232803894838e-08 5.06730088222442e-08 2.401345571673581e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 6.449343000765051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.033298657534588e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0602027 -0.1903181 1.525873 ] [ 2.2970527 0.0747319 -0.3874609 ] [ 1.995014 1.219759 3.2092236 ] [ 1.9749259 1.8771808 0.9778636 ] [ 1.5598936 3.3965281 2.6319592 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0602027e-10 -1.903181e-11 1.525873e-10 ] [ 2.2970527e-10 7.47319e-12 -3.874609e-11 ] [ 1.995014e-10 1.219759e-10 3.2092236e-10 ] [ 1.9749259e-10 1.8771808e-10 9.778636000000001e-11 ] [ 1.5598936e-10 3.3965281e-10 2.6319592e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.29e-05 -2.53e-05 -2.03e-05 ] [ -5.31e-05 1.12e-05 4.3e-06 ] [ -2.12e-05 1.4e-06 5.88e-05 ] [ 4.92e-05 2.01e-05 -2.05e-05 ] [ -7.7e-06 -7.5e-06 -2.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.271161082432e-14 -4.053506850624e-14 -3.252418540224e-14 ] [ -8.507557856448001e-14 1.794437815296e-14 6.889359469440001e-15 ] [ -3.396614436096001e-14 2.24304726912e-15 9.420798530304e-14 ] [ 7.882708974336e-14 3.220375007808e-14 -3.28446207264e-14 ] [ -1.233675998016e-14 -1.2016324656e-14 -3.572853864384e-14 ] ] } "relaxed-potential-energy" { "source-value" -4.99599539923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.004467026278599e-19 } }