{ "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" [ [ 0.284773 1.136187 2.117179 ] [ 0.232979 2.36751 0.607179 ] [ 0.4870779 2.766051 2.845032 ] [ 1.778488 1.070505 1.035652 ] [ 2.177899 0.7799475 2.527686 ] [ 2.528264 2.860392 0.629956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84773e-11 1.136187e-10 2.117179e-10 ] [ 2.32979e-11 2.36751e-10 6.07179e-11 ] [ 4.870779e-11 2.766051e-10 2.845032e-10 ] [ 1.778488e-10 1.070505e-10 1.035652e-10 ] [ 2.177899e-10 7.799475000000001e-11 2.527686e-10 ] [ 2.528264e-10 2.860392e-10 6.29956e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.9823632 -7.6475625 5.7399509 ] [ -17.5020985 9.7627112 -8.6691298 ] [ -5.6609486 10.0952155 5.8109265 ] [ 3.8999768 -0.3213398 -39.3907126 ] [ 19.5739246 -12.2313457 36.9676798 ] [ 9.6715089 0.3423213 -0.4587149 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.599350907114147e-08 -1.225274594455463e-08 9.196415212287268e-09 ] [ -2.804145326266644e-08 1.56415877691301e-08 -1.388947720267309e-08 ] [ -9.069839573195012e-09 1.617431838929462e-08 9.310130660191401e-09 ] [ 6.248451702102091e-09 -5.148431191342332e-10 -6.311087932432938e-08 ] [ 3.13608846297978e-08 -1.959677628291637e-08 5.922875278875379e-08 ] [ 1.549546557510304e-08 5.484591881805042e-10 -7.349422944476465e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 9.3311897 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.495021410476147e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2121783 1.1424199 2.5908437 ] [ -0.100077 1.8530197 0.2325461 ] [ -0.0214242 3.2843016 3.7525178 ] [ 2.2463837 1.0961508 0.2130526 ] [ 2.1342877 0.3855699 2.5713604 ] [ 3.442489 3.2191307 0.4023635 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.121783e-11 1.1424199e-10 2.5908437e-10 ] [ -1.00077e-11 1.8530197e-10 2.325461e-11 ] [ -2.14242e-12 3.2843016e-10 3.7525178e-10 ] [ 2.2463837e-10 1.0961508e-10 2.130526e-11 ] [ 2.1342877e-10 3.855699e-11 2.5713604e-10 ] [ 3.442489e-10 3.2191307e-10 4.023635e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.91e-05 -7.7e-06 7e-07 ] [ 6.6e-06 1e-07 -6.5e-06 ] [ -2.8e-06 3.3e-06 -1e-05 ] [ -1.16e-05 4.31e-05 1.69e-05 ] [ 7.6e-06 8.2e-06 -1.16e-05 ] [ -1.89e-05 -4.7e-05 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.06015737094e-14 -1.23367600818e-14 1.1215236438e-15 ] [ 1.05743657844e-14 1.602176634e-16 -1.0414148121e-14 ] [ -4.486094575199999e-15 5.2871828922e-15 -1.602176634e-14 ] [ -1.85852489544e-14 6.90538129254e-14 2.70767851146e-14 ] [ 1.21765424184e-14 1.31378483988e-14 -1.85852489544e-14 ] [ -3.02811383826e-14 -7.530230179799998e-14 1.6822854657e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.680789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.352121710448423e-18 } }