{ "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" [ [ 0.0755506 0.3541964 0.6731301 ] [ 0.5631114 0.1579036 2.39025 ] [ 0.1113923 2.692001 2.732528 ] [ 1.634511 1.700059 1.731597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.555059999999999e-12 3.541964e-11 6.731301e-11 ] [ 5.631114000000001e-11 1.579036e-11 2.39025e-10 ] [ 1.113923e-11 2.692001e-10 2.732528e-10 ] [ 1.634511e-10 1.700059e-10 1.731597e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.3979142 -1.0341799 -22.3425122 ] [ 0.1514939 -10.0751642 23.0197147 ] [ -3.8151936 3.3631073 3.2813129 ] [ 12.0616139 7.7462367 -3.9585154 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.34549419055768e-08 -1.656938871132456e-09 -3.579665099169993e-08 ] [ 2.427199867735325e-10 -1.61421926649533e-08 3.688164901368631e-08 ] [ -6.112614040106342e-09 5.388291933694827e-09 5.257242857222778e-09 ] [ 1.932483595890961e-08 1.241083944217327e-08 -6.342240879209162e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.94384297 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.512203152699163e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6346566 0.1248644 0.6096774 ] [ -0.3379831 0.1536637 2.7818106 ] [ 0.5576269 2.3272136 3.1540769 ] [ 1.5302649 2.2984183 0.9819402 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.346566e-11 1.248644e-11 6.096774000000001e-11 ] [ -3.379831e-11 1.536637e-11 2.7818106e-10 ] [ 5.576269000000001e-11 2.3272136e-10 3.1540769e-10 ] [ 1.5302649e-10 2.2984183e-10 9.819402e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.8e-06 1.32e-05 -1e-06 ] [ -1.56e-05 -2.16e-05 1.58e-05 ] [ 6.8e-06 5.5e-06 -1.39e-05 ] [ 4e-06 3e-06 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.690447843199998e-15 2.11487315688e-14 -1.602176634e-15 ] [ -2.49939554904e-14 -3.46070152944e-14 2.53143908172e-14 ] [ 1.08948011112e-14 8.811971486999999e-15 -2.22702552126e-14 ] [ 6.408706535999999e-15 4.806529901999999e-15 -1.4419589706e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.6379755 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383956251116446e-18 } }