{ "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" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2167291 -2.6741739 -14.5577523 ] [ 2.9833492 -8.1305636 13.5260233 ] [ 4.1115502 10.23668 1.2076059 ] [ -0.8781703 0.5680575 -0.1758769 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.96029810392785e-09 -4.284498937832652e-09 -2.332409057861976e-08 ] [ 4.779852379302592e-09 -1.302659902117092e-08 2.167107848219957e-08 ] [ 6.587429659958026e-09 1.640096950573512e-08 1.93479795606054e-09 ] [ -1.40698393533277e-09 9.101284532684548e-10 -2.817858596403546e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.019677 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.440232565627218e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2282593 0.6400908 -0.2612042 ] [ 0.0159797 0.0865336 2.0801073 ] [ 0.9146087 2.2815562 1.2565033 ] [ 3.1904327 2.6079844 1.096289 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.282593e-11 6.400907999999999e-11 -2.612042e-11 ] [ 1.59797e-12 8.65336e-12 2.0801073e-10 ] [ 9.146087000000001e-11 2.2815562e-10 1.2565033e-10 ] [ 3.1904327e-10 2.6079844e-10 1.096289e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 -8.2e-06 -1.91e-05 ] [ -1.34e-05 -2.83e-05 1.89e-05 ] [ 3.02e-05 3.67e-05 2.9e-06 ] [ -1.14e-05 -2e-07 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.4915361602e-15 -1.31378483988e-14 -3.06015737094e-14 ] [ -2.14691668956e-14 -4.53415987422e-14 3.02811383826e-14 ] [ 4.838573434679999e-14 5.879988246779999e-14 4.6463122386e-15 ] [ -1.82648136276e-14 -3.204353268e-16 -4.165659248399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.326579 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.654500358295509e-18 } }