{ "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" [ [ 0.3890178 0.3060136 0.2686133 ] [ 1.00003 0.111897 2.250713 ] [ 0.4846776 2.300953 2.298336 ] [ 2.957925 0.3909324 0.2522672 ] [ 2.37443 2.221414 1.416157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.890178e-11 3.060136e-11 2.686133e-11 ] [ 1.00003e-10 1.11897e-11 2.250713e-10 ] [ 4.846776e-11 2.300953e-10 2.298336e-10 ] [ 2.957925e-10 3.909324e-11 2.522672e-11 ] [ 2.37443e-10 2.221414e-10 1.416157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0759922 0.5699826 -2.7830545 ] [ 1.463971 -1.363113 2.8053715 ] [ -3.238025 0.8597149 1.0115838 ] [ -1.0980004 -0.5270991 -0.0475769 ] [ 2.9480466 0.4605146 -0.9863239 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.217529262031578e-10 9.132127959827981e-10 -4.458944854312233e-09 ] [ 2.345540109729196e-09 -2.183947780108551e-09 4.494700629958628e-09 ] [ -5.18788795256592e-09 1.37741511333341e-09 1.620735914340023e-09 ] [ -1.759190570509048e-09 -8.445058548647214e-10 -7.622659687013952e-11 ] [ 4.723291339548929e-09 7.378257256570637e-10 -1.580265093116277e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2349837754088995 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.785191994427457e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.240127 0.4020669 0.2937454 ] [ 1.4589213 0.1649861 2.3523773 ] [ 0.2801118 2.191974 1.8219248 ] [ 2.5934703 0.3911249 0.2449441 ] [ 2.63345 2.1810581 1.7730949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.40127e-11 4.020669e-11 2.937454e-11 ] [ 1.4589213e-10 1.649861e-11 2.3523773e-10 ] [ 2.801118e-11 2.191974e-10 1.8219248e-10 ] [ 2.5934703e-10 3.911249e-11 2.449441e-11 ] [ 2.63345e-10 2.1810581e-10 1.7730949e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.7e-06 -2.2e-05 -2.35e-05 ] [ -1.64e-05 5e-06 1.75e-05 ] [ 2e-07 -3.2e-06 1.18e-05 ] [ -1.56e-05 -4.2e-06 -1.96e-05 ] [ 2.81e-05 2.44e-05 1.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.928053496960001e-15 -3.52478856576e-14 -3.76511505888e-14 ] [ -2.627569658112e-14 8.010883104e-15 2.8038090864e-14 ] [ 3.2043532416e-16 -5.126965186560001e-15 1.890568412544e-14 ] [ -2.499395528448e-14 -6.72914180736e-15 -3.140266176767999e-14 ] [ 4.502116304448e-14 3.909310954752e-14 2.227025502912e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }