{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5902693 -1.005423 -2.1274041 ] [ 0.2598775 -0.0927019 1.2313967 ] [ -1.8443088 -0.2544686 2.9359883 ] [ -2.2071415 5.8435111 0.3651177 ] [ 4.3818421 -4.4909176 -2.4050986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.457156724359814e-10 -1.610865224614598e-09 -3.408477112014066e-09 ] [ 4.16369654771952e-10 -1.485248168837395e-10 1.972915003670271e-09 ] [ -2.954908440895703e-09 -4.077036416477068e-10 4.703971813202337e-09 ] [ -3.536230510097443e-09 9.362336867805291e-09 5.849830427802682e-10 ] [ 7.020484968657176e-09 -7.195243184659247e-09 -3.853392747638811e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.401993 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.987018323592526e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9675352 0.4834792 2.2234814 ] [ 2.5671896 2.5483906 1.1548405 ] [ 2.1720525 1.5359718 4.3719388 ] [ 2.7717186 3.60088 3.3032978 ] [ 4.1223631 1.5672364 2.8292034 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9675352e-10 4.834792e-11 2.2234814e-10 ] [ 2.5671896e-10 2.5483906e-10 1.1548405e-10 ] [ 2.1720525e-10 1.5359718e-10 4.3719388e-10 ] [ 2.7717186e-10 3.60088e-10 3.3032978e-10 ] [ 4.1223631e-10 1.5672364e-10 2.8292034e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 1.22e-05 3.2e-06 ] [ 2.2e-06 -3.4e-06 -3.3e-06 ] [ 5.4e-06 1.5e-06 -3.3e-06 ] [ -8.5e-06 -8.6e-06 1.5e-06 ] [ 3.9e-06 -1.6e-06 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-15 1.954655477376e-14 5.126965186560001e-15 ] [ 3.52478856576e-15 -5.44740051072e-15 -5.28718284864e-15 ] [ 8.65175375232e-15 2.4032649312e-15 -5.28718284864e-15 ] [ -1.36185012768e-14 -1.377871893888e-14 2.4032649312e-15 ] [ 6.24848882112e-15 -2.56348259328e-15 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.9991 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.242903073224128e-18 } }