{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.4203842 -6.6401333 21.7650839 ] [ -10.2016484 -14.9656041 21.5214654 ] [ -17.8789253 1.5790609 -32.757049 ] [ -19.6642972 30.0421024 4.7152686 ] [ 28.9445174 3.2641423 -18.6416286 ] [ 12.3799694 -13.2795682 3.3968595 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.028658946179371e-08 -1.063866633225555e-08 3.487150857433048e-08 ] [ -1.634484256010173e-08 -2.397754100516863e-08 3.448118870923612e-08 ] [ -2.864519612068962e-08 2.529934456799407e-09 -5.248257807420002e-08 ] [ -3.15056772383029e-08 4.813275410495957e-08 7.554693111712347e-09 ] [ 4.63742290786188e-08 5.22973248002434e-09 -2.986718151655664e-08 ] [ 1.98348975388994e-08 -2.127621370435914e-08 5.442368875042378e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 364.13362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.834063728112714e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.3073565 0.427212 2.1612534 ] [ 0.5034909 1.0403126 2.9107188 ] [ 0.3179788 1.6588622 -0.3540964 ] [ -0.3749401 3.5954749 1.759219 ] [ 3.335794 1.4522455 -0.1522208 ] [ 2.3073565 0.427212 2.1612534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3073565e-10 4.27212e-11 2.1612534e-10 ] [ 5.034909e-11 1.0403126e-10 2.9107188e-10 ] [ 3.179788e-11 1.6588622e-10 -3.540964e-11 ] [ -3.749401e-11 3.595474900000001e-10 1.759219e-10 ] [ 3.335794e-10 1.4522455e-10 -1.522208e-11 ] [ 2.3073565e-10 4.27212e-11 2.1612534e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 13.6879912 -1.296975823800375e+110 1.0375806590403e+111 ] [ -24.1258388 1.7510352 19.1137972 ] [ -9.4590379 0.3062875 -15.5325529 ] [ -8.8602418 14.8562166 2.3424286 ] [ 15.0691362 4.4239319 -15.2920655 ] [ 13.6879912 1.296975823800375e+110 -1.0375806590403e+111 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.193057948635614e-08 -2.077984342635781e+101 1.662387474108625e+102 ] [ -3.865385488254953e-08 2.805467659637852e-09 3.06236790085525e-08 ] [ -1.515504937864113e-08 4.9072667174328e-10 -2.488589311771924e-08 ] [ -1.419567226659491e-08 2.380228291006087e-08 3.752984338813274e-09 ] [ 2.414341771529096e-08 7.087920262191324e-09 -2.450058982784226e-08 ] [ 2.193057948635614e-08 2.077984342635781e+101 -1.662387474108625e+102 ] ] } "relaxed-potential-energy" { "source-value" -7.799634e+94 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.249639124559679e+76 } }