{ "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" [ [ 0.8442817 0.9206702 0.8357587 ] [ 0.3795063 0.7207018 2.571138 ] [ 0.5352031 2.484454 2.60301 ] [ 2.861465 0.7370648 0.0976718 ] [ 2.459453 1.267265 1.961226 ] [ 1.563309 2.840378 0.3371872 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.442817e-11 9.206702e-11 8.357587e-11 ] [ 3.795063e-11 7.207018e-11 2.571138e-10 ] [ 5.352031e-11 2.484454e-10 2.60301e-10 ] [ 2.861465e-10 7.370648e-11 9.767180000000001e-12 ] [ 2.459453e-10 1.267265e-10 1.961226e-10 ] [ 1.563309e-10 2.840378e-10 3.371872000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.9890774 -8.1742172 -27.3034533 ] [ -12.2302421 -28.3563002 22.2771575 ] [ -1.1000278 27.9589648 4.0982817 ] [ 9.2306201 -4.9498105 -13.8425054 ] [ 16.496082 3.9393077 18.6506284 ] [ 1.5926452 9.5820553 -3.8801088 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.241297294149747e-08 -1.30965397990809e-08 -4.374495490477019e-08 ] [ -1.959500812078309e-08 -4.543180160712953e-08 3.569194121843785e-08 ] [ -1.762438837910425e-09 4.479520011338848e-08 6.566171179289797e-09 ] [ 1.478908384155074e-08 -7.930470725827856e-09 -2.217813870789882e-08 ] [ 2.642963713294798e-08 6.311466751076281e-09 2.98816010318968e-08 ] [ 2.551698925692256e-09 1.535214510735586e-08 -6.216619656737778e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 10.182378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.631396811015565e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0531792 1.4990562 0.5127453 ] [ -0.4052216 1.267214 2.275595 ] [ -0.3164249 2.3718086 4.2855213 ] [ 3.061848 0.3795143 0.527308 ] [ 4.7469725 0.6025491 2.0695235 ] [ 0.5028648 2.8503915 -1.2647013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0531792e-10 1.4990562e-10 5.127453e-11 ] [ -4.052216000000001e-11 1.267214e-10 2.275595e-10 ] [ -3.164249e-11 2.3718086e-10 4.2855213e-10 ] [ 3.061848e-10 3.795143000000001e-11 5.27308e-11 ] [ 4.7469725e-10 6.025491e-11 2.0695235e-10 ] [ 5.028648e-11 2.8503915e-10 -1.2647013e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-06 -2e-06 2.62e-05 ] [ 2.03e-05 -2.76e-05 1.13e-05 ] [ 7.9e-06 3.9e-06 -4.4e-06 ] [ -3.5e-05 -7.6e-06 -1.78e-05 ] [ -1.59e-05 1.79e-05 1.17e-05 ] [ 1.58e-05 1.55e-05 -2.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1215236438e-14 -3.204353268e-15 4.197702781079999e-14 ] [ 3.252418567019999e-14 -4.42200750984e-14 1.81045959642e-14 ] [ 1.26571954086e-14 6.248488872599999e-15 -7.0495771896e-15 ] [ -5.607618218999999e-14 -1.21765424184e-14 -2.851874408519999e-14 ] [ -2.54746084806e-14 2.86789617486e-14 1.87454666178e-14 ] [ 2.53143908172e-14 2.4833737827e-14 -4.34189867814e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.241848 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.121577945657963e-18 } }