{ "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" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.6777519 -1.1534259 -8.7261753 ] [ -2.1443053 -5.5821163 4.3489666 ] [ -3.703296 2.4581372 2.8172639 ] [ 5.9392825 -6.8107806 -1.4582035 ] [ 5.5860707 11.0881856 3.0181483 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.096761352882779e-09 -1.847992010805199e-09 -1.398087405466243e-08 ] [ -3.43555581951753e-09 -8.9435362304466e-09 6.967812611160065e-09 ] [ -5.933334271102157e-09 3.938369952558774e-09 4.513754355203829e-09 ] [ 9.515779565826576e-09 -1.09120734467182e-08 -2.336299556068733e-09 ] [ 8.94987187767589e-09 1.776523173541122e-08 4.835606644367265e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3552283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.018219820210653e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7011639 2.260237 0.9101655 ] [ 2.1175103 1.0348503 3.895516 ] [ 1.2162062 3.2422405 3.1540769 ] [ 3.7653513 1.4676275 2.0701456 ] [ 3.6536621 3.7697147 3.030652 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7011639e-10 2.260237e-10 9.101655e-11 ] [ 2.1175103e-10 1.0348503e-10 3.895516000000001e-10 ] [ 1.2162062e-10 3.2422405e-10 3.1540769e-10 ] [ 3.7653513e-10 1.4676275e-10 2.0701456e-10 ] [ 3.6536621e-10 3.7697147e-10 3.030652e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-06 1e-07 2.9e-06 ] [ 1.4e-06 1.9e-06 -2.5e-06 ] [ 3.7e-06 -1.5e-06 -1.6e-06 ] [ -3.9e-06 1.6e-06 1.5e-06 ] [ -2.8e-06 -2e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.56348259328e-15 1.6021766208e-16 4.646312200320001e-15 ] [ 2.24304726912e-15 3.04413557952e-15 -4.005441552e-15 ] [ 5.928053496960001e-15 -2.4032649312e-15 -2.56348259328e-15 ] [ -6.24848882112e-15 2.56348259328e-15 2.4032649312e-15 ] [ -4.48609453824e-15 -3.2043532416e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }