{ "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" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.2136626 -3.6388278 -2.9157181 ] [ 0.4787023 0.1093598 -1.9772101 ] [ 13.1247931 -25.0823808 14.7272035 ] [ 6.8603545 16.8942006 -30.9460833 ] [ -11.2501873 11.7176482 21.111808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.476191480965934e-08 -5.830044828277099e-09 -4.671495372663397e-09 ] [ 7.669656333831879e-10 1.752137148153638e-10 -3.16783979662963e-09 ] [ 2.102823665765716e-08 -4.01864041117628e-08 2.359558113746393e-08 ] [ 1.099149959030007e-08 2.706749322842534e-08 -4.958109116858931e-08 ] [ -1.802478707168108e-08 1.87737419967992e-08 3.38248452004184e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.9153699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.068760873964034e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0771587 0.1554703 0.6324644 ] [ -0.2264187 0.0818632 2.4841961 ] [ 3.3572681 0.2421456 1.2699498 ] [ 2.2698664 2.2285516 0.573853 ] [ 1.7230915 3.470381 2.3883889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0771587e-10 1.554703e-11 6.324644e-11 ] [ -2.264187e-11 8.18632e-12 2.4841961e-10 ] [ 3.3572681e-10 2.421456e-11 1.2699498e-10 ] [ 2.2698664e-10 2.2285516e-10 5.73853e-11 ] [ 1.7230915e-10 3.470381e-10 2.3883889e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 4.5e-06 4.3e-06 ] [ -3.1e-06 7e-07 -1.1e-06 ] [ 4.4e-06 2.4e-06 1e-07 ] [ -1.5e-06 -2.5e-06 -3.9e-06 ] [ 2e-07 -5.1e-06 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 7.2097947936e-15 6.889359469440001e-15 ] [ -4.96674752448e-15 1.12152363456e-15 -1.76239428288e-15 ] [ 7.04957713152e-15 3.84522388992e-15 1.6021766208e-16 ] [ -2.4032649312e-15 -4.005441552e-15 -6.24848882112e-15 ] [ 3.2043532416e-16 -8.17110076608e-15 9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.264001 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.964909567966782e-18 } }