{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.93557e-12 3.816744e-11 1.3814631e-10 ] [ 2.0118e-12 2.2985566e-10 2.6452574e-10 ] [ 2.0868892e-10 4.508821e-11 1.128124e-11 ] [ 2.1793279e-10 3.942809e-11 2.4787946e-10 ] [ 3.0360454e-10 2.5001929e-10 4.850933e-11 ] [ 2.2826938e-10 2.7117883e-10 2.6395076e-10 ] ] "source-value" [ [ 0.0793557 0.3816744 1.3814631 ] [ 0.020118 2.2985566 2.6452574 ] [ 2.0868892 0.4508821 0.1128124 ] [ 2.1793279 0.3942809 2.4787946 ] [ 3.0360454 2.5001929 0.4850933 ] [ 2.2826938 2.7117883 2.6395076 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.20074980633088e-12 4.171907702901121e-12 -1.37578906428096e-12 ] [ -2.39301100082688e-12 -3.50107635177216e-12 3.11399048018688e-12 ] [ -1.3650544809216e-12 -3.70471300027584e-12 5.298398084985601e-13 ] [ -1.7599910179488e-12 6.507240345379201e-12 3.57477647632896e-12 ] [ 4.87750628670144e-12 4.26355220561088e-12 -6.73138485462912e-12 ] [ -1.56003937567296e-12 -7.7369109018432e-12 8.887273715577601e-13 ] ] "source-value" [ [ 0.0013736 0.0026039 -0.0008587 ] [ -0.0014936 -0.0021852 0.0019436 ] [ -0.000852 -0.0023123 0.0003307 ] [ -0.0010985 0.0040615 0.0022312 ] [ 0.0030443 0.0026611 -0.0042014 ] [ -0.0009737 -0.004829 0.0005547 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.961888964214867e-18 "source-value" -18.486657 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.512729643374608e-09 1.055103960785777e-09 -5.971919490660884e-10 ] [ 1.265442033441278e-09 -1.229984743299339e-09 -7.659799743260716e-10 ] [ -2.524172549018024e-09 4.706755915516301e-09 3.212735829680025e-09 ] [ 9.249315964403156e-10 3.905405168585814e-09 -1.530608192237174e-09 ] [ -1.502417894594199e-09 -5.40165292079565e-09 4.111760710814992e-09 ] [ -6.765128296439788e-10 -3.035627541010566e-09 -4.430716424865682e-09 ] ] "source-value" [ [ 1.5683225 0.6585441 -0.3727379 ] [ 0.7898268 -0.7676961 -0.4780871 ] [ -1.5754646 2.937726 2.005232 ] [ 0.5772969 2.4375622 -0.9553305 ] [ -0.9377355 -3.3714466 2.5663592 ] [ -0.4222461 -1.8946897 -2.7654357 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.250969071203884e-18 "source-value" -14.049444 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.179265e-12 4.638875e-12 1.270674e-10 ] [ 1.114538e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451329e-12 ] [ 1.93577e-10 5.270405e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] "source-value" [ [ 0.03179265 0.04638875 1.270674 ] [ 0.01114538 2.887791 2.968384 ] [ 2.5478 0.1715431 0.08451329 ] [ 1.93577 0.005270405 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] } "instance-id" 1 }