{ "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" [ [ -12.8211515 -30.5428572 2.4579565 ] [ 18.5260192 0.7303788 -7.4147434 ] [ 7.2064305 1.8072309 -7.5412214 ] [ -2.6082182 7.8047246 0.9098479 ] [ -11.5365266 10.392813 15.7187424 ] [ 1.2334467 9.8077099 -4.1305821 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.054174918503485e-08 -4.893505173827295e-08 3.938080439243395e-09 ] [ 2.968195483873192e-08 1.170195837687959e-09 -1.18797285247111e-08 ] [ 1.154597446652005e-08 2.895503096367343e-09 -1.208236861935665e-08 ] [ -4.178826221985058e-09 1.250454728590263e-08 1.457737033863976e-09 ] [ -1.848355320375731e-08 1.665112201294631e-08 2.518420158165768e-08 ] [ 1.976199465742911e-09 1.571368350536871e-08 -6.617922070914968e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 25.854846 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.14240297955844e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3329249 -0.6701022 1.27519 ] [ 0.921754 1.3906012 2.6980942 ] [ 0.7750245 1.5604658 0.201275 ] [ -0.0048966 3.3845626 1.6297099 ] [ 2.6388126 1.5224969 0.540464 ] [ 2.7334173 1.4132946 2.1413943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3329249e-10 -6.701022e-11 1.27519e-10 ] [ 9.21754e-11 1.3906012e-10 2.6980942e-10 ] [ 7.750245000000001e-11 1.5604658e-10 2.01275e-11 ] [ -4.896600000000001e-13 3.3845626e-10 1.6297099e-10 ] [ 2.6388126e-10 1.5224969e-10 5.404640000000001e-11 ] [ 2.7334173e-10 1.4132946e-10 2.1413943e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001013 -6.93e-05 -0.0001056 ] [ 0.0001226 8.51e-05 -5.21e-05 ] [ 0.0001281 2.08e-05 8.82e-05 ] [ -1.28e-05 -0.0001029 -7.7e-06 ] [ -0.0001117 -6.03e-05 -2.52e-05 ] [ -2.49e-05 0.0001266 0.0001024 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6230049168704e-13 -1.1103083982144e-13 -1.6918985115648e-13 ] [ 1.9642685371008e-13 1.3634523043008e-13 -8.347340194367999e-14 ] [ 2.0523882512448e-13 3.332527371264e-14 1.4131197795456e-13 ] [ -2.050786074624e-14 -1.6486397428032e-13 -1.233675998016e-14 ] [ -1.7896312854336e-13 -9.661125023424001e-14 -4.037485084416e-14 ] [ -3.989419785791999e-14 2.0283556019328e-13 1.6406288596992e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.500353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.643647981154715e-18 } }