{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6767306 4.2980616 -7.2661579 ] [ -1.0361154 -3.3980396 7.2191309 ] [ 3.2208858 1.0108799 -0.1443133 ] [ 1.3383934 -1.0931131 -4.3950431 ] [ -1.8464332 -0.8177889 4.5863834 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.6864185888328e-09 6.886253867012654e-09 -1.164166840633451e-08 ] [ -1.660039884007563e-09 -5.444259648526706e-09 1.156632284576739e-08 ] [ 5.160427969542396e-09 1.619608155560256e-09 -2.312153972354322e-10 ] [ 2.144342632579815e-09 -1.751360267139305e-09 -7.041635360242924e-09 ] [ -2.958312129281848e-09 -1.310242267124562e-09 7.348196318045474e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.31492 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.652632380557928e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5498647 1.6012286 0.8974474 ] [ 1.3247958 0.2888819 2.7515888 ] [ 3.591059 0.8694658 2.2153421 ] [ 2.8161323 2.1818047 0.3612062 ] [ 1.9612574 2.5879742 2.559406 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.498647e-11 1.6012286e-10 8.974474e-11 ] [ 1.3247958e-10 2.888819e-11 2.7515888e-10 ] [ 3.591059e-10 8.694658e-11 2.2153421e-10 ] [ 2.8161323e-10 2.1818047e-10 3.612062e-11 ] [ 1.9612574e-10 2.5879742e-10 2.559406e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.64e-05 -1.8e-05 -1.35e-05 ] [ -1.69e-05 -7.3e-06 5e-06 ] [ -1.7e-06 9.2e-06 2.49e-05 ] [ 2e-06 2.58e-05 -2.32e-05 ] [ 4.3e-05 -9.7e-06 6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.22974631376e-14 -2.8839179412e-14 -2.162938455899999e-14 ] [ -2.70767851146e-14 -1.16958894282e-14 8.010883169999999e-15 ] [ -2.7237002778e-15 1.47400250328e-14 3.989419818659999e-14 ] [ 3.204353268e-15 4.133615715719999e-14 -3.71704979088e-14 ] [ 6.889359526199999e-14 -1.55411133498e-14 1.10550187746e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }