{ "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" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.5041044 -6.6539218 6.1173375 ] [ -13.3346963 11.5319506 -3.3950054 ] [ 9.567114 -12.5059294 -13.6242248 ] [ 7.6487762 9.1699164 1.0612573 ] [ 3.6229106 -1.5420158 9.8406353 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.202290072877659e-08 -1.066075803242322e-08 9.801055204791974e-09 ] [ -2.136453883334625e-08 1.847622179576228e-08 -5.439398324183822e-09 ] [ 1.532820650561427e-08 -2.003670787113364e-08 -2.182841463092332e-08 ] [ 1.225469050633531e-08 1.46918257918134e-08 1.700321648721928e-09 ] [ 5.80454271039092e-09 -2.470581684018817e-09 1.576643594137558e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.0998119 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.966446195975145e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2771533 0.6238408 1.5913508 ] [ -0.2562239 2.8934835 0.8419401 ] [ 2.0379392 0.4520257 -0.1020184 ] [ 2.1683933 2.6132944 1.0422213 ] [ 1.886604 1.5101938 3.2104346 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.771533e-11 6.238408e-11 1.5913508e-10 ] [ -2.562239e-11 2.8934835e-10 8.419401e-11 ] [ 2.0379392e-10 4.520257e-11 -1.020184e-11 ] [ 2.1683933e-10 2.6132944e-10 1.0422213e-10 ] [ 1.886604e-10 1.5101938e-10 3.2104346e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.83e-05 2.8e-05 -8.9e-06 ] [ 5e-07 1.2e-06 6e-07 ] [ -1e-07 -1.4e-06 6e-07 ] [ -2.85e-05 -2.75e-05 7.2e-06 ] [ -2e-07 -3e-07 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.53415987422e-14 4.486094575199999e-14 -1.42593720426e-14 ] [ 8.010883169999999e-16 1.9226119608e-15 9.613059803999998e-16 ] [ -1.602176634e-16 -2.2430472876e-15 9.613059803999998e-16 ] [ -4.5662034069e-14 -4.4059857435e-14 1.15356717648e-14 ] [ -3.204353268e-16 -4.806529901999999e-16 8.010883169999999e-16 ] ] } "relaxed-potential-energy" { "source-value" -10.968569 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.757358496021675e-18 } }