{ "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" [ [ 0.489786 0.6379758 2.385139 ] [ 2.264964 0.0865491 0.9234604 ] [ 2.944507 2.806058 0.1090737 ] [ 1.576252 2.005156 0.0788695 ] [ 2.792909 2.291732 2.895835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.89786e-11 6.379758e-11 2.385139e-10 ] [ 2.264964e-10 8.654910000000001e-12 9.234604e-11 ] [ 2.944507e-10 2.806058e-10 1.090737e-11 ] [ 1.576252e-10 2.005156e-10 7.88695e-12 ] [ 2.792909e-10 2.291732e-10 2.895835e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0427887 0.4742836 1.872999 ] [ 1.1995488 -5.6067492 1.4157723 ] [ 26.1376183 17.1120578 1.4619051 ] [ -26.6169877 -11.5354685 -3.8098664 ] [ -0.6773908 -0.4441237 -0.9408101 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.855505477442495e-11 7.59886095548859e-10 3.000875208581779e-09 ] [ 1.921889042868695e-09 -8.983002486929103e-09 2.268317279436243e-09 ] [ 4.187708096365424e-08 2.741653894093828e-08 2.342230173048286e-09 ] [ -4.264511540906116e-08 -1.848185794067485e-08 -6.104078874451461e-09 ] [ -1.085299702905009e-09 -7.11564608883193e-10 -1.50734394683251e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.93394508 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.496344972287186e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.504705 0.5317721 2.9139586 ] [ 1.1837372 -0.15644 0.6880696 ] [ 2.841187 3.2685842 0.6325807 ] [ 2.0097103 1.5350104 -0.7218935 ] [ 2.5290785 2.6485442 2.8796621 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.504705e-10 5.317721e-11 2.9139586e-10 ] [ 1.1837372e-10 -1.5644e-11 6.880696e-11 ] [ 2.841187e-10 3.2685842e-10 6.325807000000001e-11 ] [ 2.0097103e-10 1.5350104e-10 -7.218935e-11 ] [ 2.5290785e-10 2.6485442e-10 2.8796621e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.6e-06 3.8e-06 -1e-06 ] [ -5.1e-06 -8.6e-06 1.2e-05 ] [ 4e-07 1.3e-06 7.7e-06 ] [ 1.3e-06 1.1e-06 -3.47e-05 ] [ 7e-07 2.4e-06 1.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.16565921408e-15 6.08827115904e-15 -1.6021766208e-15 ] [ -8.17110076608e-15 -1.377871893888e-14 1.92261194496e-14 ] [ 6.408706483200001e-16 2.08282960704e-15 1.233675998016e-14 ] [ 2.08282960704e-15 1.76239428288e-15 -5.559552874176001e-14 ] [ 1.12152363456e-15 3.84522388992e-15 2.56348259328e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736295466597816e-18 } }