{ "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" [ [ 0.3247182 0.2574581 0.2093782 ] [ 0.0650872 0.6230634 2.300965 ] [ 0.7071473 2.551012 0.1142943 ] [ 0.540381 2.928346 2.93806 ] [ 2.649535 1.391538 0.3805226 ] [ 1.868471 1.381011 2.58095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.247182e-11 2.574581e-11 2.093782e-11 ] [ 6.50872e-12 6.230634000000001e-11 2.300965e-10 ] [ 7.071473000000001e-11 2.551012e-10 1.142943e-11 ] [ 5.40381e-11 2.928346e-10 2.93806e-10 ] [ 2.649535e-10 1.391538e-10 3.805226e-11 ] [ 1.868471e-10 1.381011e-10 2.58095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.3382874 -12.446131 -13.1469435 ] [ -17.5885684 -19.5714481 10.4905139 ] [ -5.4445399 18.1379776 -19.2038375 ] [ -4.0205056 15.5936085 5.8171304 ] [ 14.1109598 1.1432293 -4.0910974 ] [ 24.2809415 -2.8572363 20.1342343 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.816593899219122e-08 -1.994090010761412e-08 -2.106372551067852e-08 ] [ -2.817999308382167e-08 -3.135691658102058e-08 1.680765611075743e-08 ] [ -8.723114538792769e-09 2.906024365931409e-08 -3.076793947214232e-08 ] [ -6.441560076115477e-09 2.498371497260816e-08 9.320070327024953e-09 ] [ 2.260824988860865e-08 1.831655256673549e-09 -6.554660607695666e-09 ] [ 3.890235680231249e-08 -4.577797199961095e-09 3.225859947316945e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.7886256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.274400602884373e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.495615 0.5805171 0.2377226 ] [ 0.3282195 -0.3052029 2.3011709 ] [ 0.7882389 2.5811333 0.0061187 ] [ 0.5892793 3.34375 2.3769492 ] [ 2.9897896 1.6059678 0.6726239 ] [ 1.9554273 1.3262632 2.9295847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.956150000000001e-11 5.805171e-11 2.377226e-11 ] [ 3.282195e-11 -3.052029e-11 2.3011709e-10 ] [ 7.882389e-11 2.5811333e-10 6.118700000000001e-13 ] [ 5.892792999999999e-11 3.34375e-10 2.3769492e-10 ] [ 2.9897896e-10 1.6059678e-10 6.726239e-11 ] [ 1.9554273e-10 1.3262632e-10 2.9295847e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.73e-05 1.71e-05 1.72e-05 ] [ 4e-06 2e-05 2.2e-06 ] [ -1.51e-05 -3.2e-06 -1.2e-05 ] [ -1.63e-05 -9.5e-06 1.28e-05 ] [ 1.54e-05 -1.6e-05 -8.2e-06 ] [ -1.53e-05 -8.4e-06 -1.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.373942174784e-14 2.739722021568e-14 2.755743787776e-14 ] [ 6.4087064832e-15 3.2043532416e-14 3.52478856576e-15 ] [ -2.419286697408e-14 -5.126965186560001e-15 -1.92261194496e-14 ] [ -2.611547891904e-14 -1.52206778976e-14 2.050786074624e-14 ] [ 2.467351996032e-14 -2.56348259328e-14 -1.313784829056e-14 ] [ -2.451330229824e-14 -1.345828361472e-14 -1.92261194496e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }