{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.754518 -2.9167111 4.4684081 ] [ -2.6189026 -3.3582911 5.7804918 ] [ -5.6692453 1.3864236 -10.9096032 ] [ 2.8023425 -1.8507358 0.2444878 ] [ 4.6668642 -3.2417408 1.5356799 ] [ 4.756076 3.7637102 -2.0456104 ] [ 0.8173831 6.217345 0.9261461 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.617577645532412e-09 -4.673086372548437e-09 7.159179048996336e-09 ] [ -4.195944552441848e-09 -5.380575530590156e-09 9.2613688949886e-09 ] [ -9.08313235207432e-09 2.221295496746162e-09 -1.747911133325163e-08 ] [ 4.489847673965145e-09 -2.965205654467297e-09 3.917126404580652e-10 ] [ 7.477140775291103e-09 -5.193841363244468e-09 2.460430453083456e-09 ] [ 7.620073836728184e-09 6.030128539587466e-09 -3.277429185147394e-09 ] [ 1.309592103846485e-09 9.96128488451673e-09 1.483849641090227e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.377888 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.264897600386899e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5247483 2.7420874 0.4427157 ] [ 1.7113765 4.9819834 1.2634833 ] [ 2.0766926 3.0833956 2.8803593 ] [ 4.9717508 2.4861691 0.9668437 ] [ 4.5371764 2.8173899 3.3313083 ] [ 4.0865119 4.7821036 0.4442563 ] [ 3.6383385 5.123495 2.8818722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5247483e-10 2.7420874e-10 4.427157e-11 ] [ 1.7113765e-10 4.9819834e-10 1.2634833e-10 ] [ 2.0766926e-10 3.0833956e-10 2.8803593e-10 ] [ 4.9717508e-10 2.4861691e-10 9.668437e-11 ] [ 4.5371764e-10 2.8173899e-10 3.3313083e-10 ] [ 4.0865119e-10 4.7821036e-10 4.442563e-11 ] [ 3.6383385e-10 5.123495e-10 2.8818722e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001385 -6.94e-05 -7.46e-05 ] [ 2.4e-05 -1.3e-05 6.07e-05 ] [ -2.21e-05 -2.46e-05 2.6e-05 ] [ 9.56e-05 -1.91e-05 0.0001102 ] [ 2.3e-06 -9.1e-05 2.78e-05 ] [ 2.16e-05 0.0001639 -7.38e-05 ] [ 1.71e-05 5.32e-05 -7.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.21901463809e-13 -1.111910583996e-13 -1.195223768964e-13 ] [ 3.8452239216e-14 -2.082829624199999e-14 9.725212168379999e-14 ] [ -3.54081036114e-14 -3.94135451964e-14 4.165659248399999e-14 ] [ 1.531680862104e-13 -3.06015737094e-14 1.765598650668e-13 ] [ 3.685006258199999e-15 -1.45798073694e-13 4.454051042519999e-14 ] [ 3.46070152944e-14 2.625967503126e-13 -1.182406355892e-13 ] [ 2.73972204414e-14 8.523579692879999e-14 -1.222460771742e-13 ] ] } "relaxed-potential-energy" { "source-value" -25.011241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.007242591754279e-18 } }