{ "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" [ [ 0.4523459 0.4778673 0.765296 ] [ 0.8876723 1.989638 2.471047 ] [ 2.135329 1.164008 0.2412907 ] [ 2.495776 0.5844002 2.912252 ] [ 2.604983 2.71818 1.724062 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.523459e-11 4.778673e-11 7.65296e-11 ] [ 8.876723e-11 1.989638e-10 2.471047e-10 ] [ 2.135329e-10 1.164008e-10 2.412907e-11 ] [ 2.495776e-10 5.844002e-11 2.912252e-10 ] [ 2.604983e-10 2.71818e-10 1.724062e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -23.7522699 -13.3292484 -9.9469947 ] [ -24.3486044 11.0579813 21.972711 ] [ 16.6804143 -4.2886139 -34.9665749 ] [ 14.7246317 -17.3150869 25.2112286 ] [ 16.6958283 23.8749679 -2.27037 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.805533152471155e-08 -2.135581015931581e-08 -1.593684235556151e-08 ] [ -3.901076471878801e-08 1.771683911210359e-08 3.520416385979499e-08 ] [ 2.672496981671799e-08 -6.871116926217909e-09 -5.60226288142321e-08 ] [ 2.359146065963056e-08 -2.774182741830035e-08 4.039284104456431e-08 ] [ 2.674966576715101e-08 3.825191539173047e-08 -3.637533734565696e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 14.127864 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.263533340264197e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4282151 0.4246753 0.6835121 ] [ 1.1092423 1.7010799 2.6457726 ] [ 2.0666051 1.6241106 -0.6657001 ] [ 2.2250047 0.2831013 4.1540286 ] [ 2.7470391 2.9011263 1.2963345 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.282151000000001e-11 4.246753e-11 6.835121e-11 ] [ 1.1092423e-10 1.7010799e-10 2.6457726e-10 ] [ 2.0666051e-10 1.6241106e-10 -6.657001e-11 ] [ 2.2250047e-10 2.831013e-11 4.154028600000001e-10 ] [ 2.7470391e-10 2.9011263e-10 1.2963345e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.6e-06 6.6e-06 5.5e-06 ] [ 2.1e-06 -1.3e-06 -1.21e-05 ] [ -3.1e-06 -6e-07 7.4e-06 ] [ -2e-07 3e-06 -4.7e-06 ] [ -5.4e-06 -7.7e-06 4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.057436569728e-14 1.057436569728e-14 8.8119714144e-15 ] [ 3.36457090368e-15 -2.08282960704e-15 -1.938633711168e-14 ] [ -4.96674752448e-15 -9.6130597248e-16 1.185610699392e-14 ] [ -3.2043532416e-16 4.8065298624e-15 -7.53023011776e-15 ] [ -8.65175375232e-15 -1.233675998016e-14 6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.419499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.669387769824898e-18 } }