{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4524811 -4.0067151 0.2568377 ] [ -3.1415879 3.0390668 0.6446854 ] [ 1.1165403 -2.2727073 -2.2982701 ] [ 3.2257758 -0.2063199 4.8292038 ] [ 3.2517528 3.4466755 -3.4324568 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.133661122973867e-09 -6.419465259426335e-09 4.114993582800441e-10 ] [ -5.033378685568169e-09 4.86912177600947e-09 1.032899875651096e-09 ] [ 1.788894764841018e-09 -3.641278501981492e-09 -3.682234622503678e-09 ] [ 5.168262570702417e-09 -3.305609201857939e-10 7.73723742543852e-09 ] [ 5.209882312780939e-09 5.52218290558415e-09 -5.499402036865982e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.5597909 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.211212023811659e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3125726 1.4080369 3.0082556 ] [ 1.4864445 3.9436916 3.0790654 ] [ 3.4907419 1.2951631 1.701492 ] [ 3.6695889 2.4831526 4.3705686 ] [ 3.6646181 3.8308218 1.7723004 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3125726e-10 1.4080369e-10 3.0082556e-10 ] [ 1.4864445e-10 3.9436916e-10 3.0790654e-10 ] [ 3.4907419e-10 1.2951631e-10 1.701492e-10 ] [ 3.6695889e-10 2.4831526e-10 4.370568600000001e-10 ] [ 3.6646181e-10 3.8308218e-10 1.7723004e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 3.8e-06 -1.64e-05 ] [ 4.9e-06 -1.04e-05 -2.44e-05 ] [ -1.87e-05 1.86e-05 -7.7e-06 ] [ 3.48e-05 -7.7e-06 6.44e-05 ] [ -1.71e-05 -4.3e-06 -1.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.24848882112e-15 6.08827115904e-15 -2.627569658112e-14 ] [ 7.850665441919999e-15 -1.666263685632e-14 -3.909310954752e-14 ] [ -2.996070280896e-14 2.980048514688e-14 -1.233675998016e-14 ] [ 5.575574640383999e-14 -1.233675998016e-14 1.0318017437952e-13 ] [ -2.739722021568e-14 -6.889359469440001e-15 -2.547460827072e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.743551 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.041741947817246e-18 } }