{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.131218 -5.3783713 2.0610059 ] [ -11.9216134 14.8316206 -3.8233597 ] [ -3.201531 2.1190669 4.3954188 ] [ 8.1294474 -10.4274654 -9.0728731 ] [ 10.1249151 -1.1448508 6.4398081 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.016764274228135e-09 -8.617100754841705e-09 3.302095468310863e-09 ] [ -1.9100530271696e-08 2.376287577389567e-08 -6.125697524248901e-09 ] [ -5.129418118966445e-09 3.395119445091131e-09 7.042237239984791e-09 ] [ 1.302481056430334e-08 -1.670664127808092e-08 -1.453634516430522e-08 ] [ 1.62219022608049e-08 -1.834253186064177e-09 1.031770998025847e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.2446075 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.402787521772336e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5722209 1.8184134 2.240367 ] [ 2.7900148 3.8835202 1.1745388 ] [ 2.8328101 3.633915 3.7052076 ] [ 4.7141083 2.2831825 0.3868536 ] [ 5.003842 3.9550669 2.4244484 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5722209e-10 1.8184134e-10 2.240367e-10 ] [ 2.7900148e-10 3.8835202e-10 1.1745388e-10 ] [ 2.8328101e-10 3.633915e-10 3.7052076e-10 ] [ 4.7141083e-10 2.2831825e-10 3.868536e-11 ] [ 5.003842e-10 3.9550669e-10 2.4244484e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 -1.6e-06 -1.46e-05 ] [ 1.68e-05 -1.65e-05 3.35e-05 ] [ 2.15e-05 1.45e-05 -2.22e-05 ] [ -7.2e-06 8.7e-06 8.4e-06 ] [ -2.92e-05 -5.1e-06 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 -2.56348259328e-15 -2.339177866368e-14 ] [ 2.691656722944e-14 -2.64359142432e-14 5.36729167968e-14 ] [ 3.44467973472e-14 2.32315610016e-14 -3.556832098176e-14 ] [ -1.153567166976e-14 1.393893660096e-14 1.345828361472e-14 ] [ -4.678355732736e-14 -8.17110076608e-15 -8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.498488 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.842260864814935e-18 } }