{ "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" [ [ 2.053874 2.225583 2.945298 ] [ 1.808711 4.658327 2.287931 ] [ 4.038397 2.121863 2.154331 ] [ 3.514533 3.432892 3.895035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.053874e-10 2.225583e-10 2.945298000000001e-10 ] [ 1.808711e-10 4.658327e-10 2.287931e-10 ] [ 4.038397e-10 2.121863e-10 2.154331e-10 ] [ 3.514533e-10 3.432892e-10 3.895035e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.923401 -1.0966574 -0.7274263 ] [ -0.0058196 -0.4988714 0.5078285 ] [ 3.373177 -1.7909733 -2.6393693 ] [ 1.5560436 3.3865021 2.8589671 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.888157977023341e-09 -1.757038847307314e-09 -1.165465411215047e-09 ] [ -9.32402706240768e-12 -7.992800938657653e-10 8.136309500759328e-10 ] [ 5.404425327220282e-09 -2.869455549737025e-09 -4.228735786117261e-09 ] [ 2.493056676865467e-09 5.425774490910103e-09 4.580570247256376e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5983077 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.969477712984621e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7014941 2.1454742 2.1176777 ] [ 1.7436673 4.3342249 2.9610256 ] [ 3.9640896 1.8851068 2.6802737 ] [ 4.0062639 4.073859 3.5236179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7014941e-10 2.1454742e-10 2.1176777e-10 ] [ 1.7436673e-10 4.3342249e-10 2.9610256e-10 ] [ 3.9640896e-10 1.8851068e-10 2.6802737e-10 ] [ 4.0062639e-10 4.073859e-10 3.5236179e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 3e-07 1.3e-06 ] [ -1.7e-06 2.5e-06 -6e-07 ] [ 2e-06 -1.2e-06 -9e-07 ] [ -1.1e-06 -1.6e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 4.8065298624e-16 2.08282960704e-15 ] [ -2.72370025536e-15 4.005441552e-15 -9.6130597248e-16 ] [ 3.2043532416e-15 -1.92261194496e-15 -1.44195895872e-15 ] [ -1.76239428288e-15 -2.56348259328e-15 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.4643956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.195928011872239e-18 } }