{ "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" [ [ -11.7113189 -8.4268601 -1.3796338 ] [ 1.1388792 0.3118801 -3.2188942 ] [ 10.4093286 -13.3552511 3.9333634 ] [ 5.9109178 11.0728203 -7.4032977 ] [ -5.7478067 10.3974108 8.0684623 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.876360134031318e-08 -1.350131823897235e-08 -2.210417019625463e-09 ] [ 1.824685628155408e-09 4.996870047127661e-10 -5.157237032068719e-09 ] [ 1.667758292114479e-08 -2.139747107733348e-08 6.3019428805904e-09 ] [ 9.470334306630571e-09 1.774061381097964e-08 -1.186139049176241e-08 ] [ -9.209001515617599e-09 1.665848850061343e-08 1.29271016628662e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.4681357 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.352212694701843e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0090905 0.0798043 0.7492652 ] [ -0.4446905 -0.3448512 2.4828893 ] [ 3.4128506 0.222381 1.1761027 ] [ 2.2735251 2.3210032 0.6485205 ] [ 1.9501902 3.9000744 2.2920744 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0090905e-10 7.98043e-12 7.492652e-11 ] [ -4.446905e-11 -3.448512e-11 2.4828893e-10 ] [ 3.4128506e-10 2.22381e-11 1.1761027e-10 ] [ 2.2735251e-10 2.3210032e-10 6.485205000000001e-11 ] [ 1.9501902e-10 3.9000744e-10 2.2920744e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.4e-06 5.5e-06 -1.74e-05 ] [ -2.04e-05 2.73e-05 2.2e-05 ] [ 2.15e-05 2.99e-05 -1.95e-05 ] [ 1.38e-05 -3.7e-05 1.32e-05 ] [ -2.14e-05 -2.57e-05 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.025393037312e-14 8.8119714144e-15 -2.787787320192e-14 ] [ -3.268440306432e-14 4.373942174784e-14 3.52478856576e-14 ] [ 3.44467973472e-14 4.790508096192e-14 -3.12424441056e-14 ] [ 2.211003736704e-14 -5.92805349696e-14 2.114873139456e-14 ] [ -3.428657968511999e-14 -4.117593915456e-14 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.43434 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992200884307827e-18 } }