{ "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" [ [ 1.063375 0.5708417 2.359419 ] [ 2.68579 2.886891 2.868985 ] [ 0.6763911 2.686272 1.583941 ] [ 2.607368 0.7750333 4.497523 ] [ 3.625325 0.6457468 2.38821 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.063375e-10 5.708417e-11 2.359419e-10 ] [ 2.68579e-10 2.886891e-10 2.868985e-10 ] [ 6.763911e-11 2.686272e-10 1.583941e-10 ] [ 2.607368e-10 7.750333e-11 4.497523e-10 ] [ 3.625325e-10 6.457468e-11 2.38821e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.715205 -2.5178107 0.0107065 ] [ 1.2324387 1.5322955 0.3479094 ] [ 0.2445371 0.4827403 0.183005 ] [ -0.4267601 0.3220524 -0.4030081 ] [ -0.3350107 0.1807225 -0.1386127 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.14588473951997e-09 -4.033977472375184e-09 1.7153704131921e-11 ] [ 1.974584487977336e-09 2.455008046483347e-09 5.574123114289596e-10 ] [ 3.917916277661214e-10 7.734352289501501e-10 2.9320633490517e-10 ] [ -6.837450605435032e-10 5.159848302036216e-10 -6.456901611327353e-10 ] [ -5.367463156799838e-10 2.895493667380649e-10 -2.220820291156518e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.279970432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.807250505946626e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2710793 0.2181866 2.4550685 ] [ 2.9922173 2.8077268 3.0241641 ] [ 0.9120097 2.5077048 1.9018691 ] [ 1.9920265 1.220456 4.4928466 ] [ 3.4909164 0.8107106 1.8241298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2710793e-10 2.181866e-11 2.4550685e-10 ] [ 2.9922173e-10 2.807726800000001e-10 3.0241641e-10 ] [ 9.120097000000001e-11 2.5077048e-10 1.9018691e-10 ] [ 1.9920265e-10 1.220456e-10 4.4928466e-10 ] [ 3.4909164e-10 8.107106e-11 1.8241298e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.01e-05 -1.6e-05 -5.2e-06 ] [ 5.88e-05 2.96e-05 8.5e-06 ] [ -4.21e-05 -8.1e-06 -1.09e-05 ] [ -4.9e-06 -9.4e-06 -4.1e-06 ] [ 8.3e-06 4e-06 1.17e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.22037503434e-14 -2.5634826144e-14 -8.331318496799998e-15 ] [ 9.420798607919999e-14 4.74244283664e-14 1.3618501389e-14 ] [ -6.745163629139998e-14 -1.29776307354e-14 -1.74637253106e-14 ] [ -7.850665506599998e-15 -1.50604603596e-14 -6.568924199399999e-15 ] [ 1.32980660622e-14 6.408706535999999e-15 1.87454666178e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }