{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5353879 0.9970923 2.660459 ] [ 0.8434423 2.30713 1.528251 ] [ 1.912844 1.041012 0.0827139 ] [ 2.263312 0.2132627 1.656325 ] [ 2.91731 1.870919 1.650254 ] [ 2.184429 2.813613 2.907386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.353879e-11 9.970923e-11 2.660459e-10 ] [ 8.434423e-11 2.30713e-10 1.528251e-10 ] [ 1.912844e-10 1.041012e-10 8.27139e-12 ] [ 2.263312e-10 2.132627e-11 1.656325e-10 ] [ 2.91731e-10 1.870919e-10 1.650254e-10 ] [ 2.184429e-10 2.813613e-10 2.907386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.8964371 -16.5345743 19.7786272 ] [ -20.9015806 23.4424997 -15.8966668 ] [ -3.9544118 -0.4771852 -28.9056876 ] [ 5.3853817 -36.7592055 10.0857948 ] [ 37.577484 10.3934445 -9.4279506 ] [ -0.2104363 19.9350208 24.365883 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.867325311723775e-08 -2.649130837834052e-08 3.168885409135896e-08 ] [ -3.348802377508683e-08 3.755902495245102e-08 -2.546926789560755e-08 ] [ -6.335666134975645e-09 -7.645349712317722e-10 -4.631201688086846e-08 ] [ 8.628332653824159e-09 -5.889473965128278e-08 1.615922463074621e-08 ] [ 6.020576633328607e-08 1.665213378748234e-08 -1.510524203337734e-08 ] [ -3.371561200276551e-10 3.193942426092171e-08 3.903844808774817e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.136629 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.944502323912328e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1438729 1.012462 3.1855096 ] [ 0.7382871 2.4299289 1.1861628 ] [ 2.0119319 0.9329047 -0.3939216 ] [ 2.1901439 0.143771 1.9946846 ] [ 3.3703743 2.3370967 1.137223 ] [ 2.2021151 2.3868657 3.3757306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.438729e-11 1.012462e-10 3.1855096e-10 ] [ 7.382871e-11 2.4299289e-10 1.1861628e-10 ] [ 2.0119319e-10 9.329047000000001e-11 -3.939216e-11 ] [ 2.1901439e-10 1.43771e-11 1.9946846e-10 ] [ 3.3703743e-10 2.3370967e-10 1.137223e-10 ] [ 2.2021151e-10 2.3868657e-10 3.3757306e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.76e-05 7.8e-06 -3.5e-05 ] [ -8.2e-06 5.9e-06 -1.01e-05 ] [ -1.74e-05 -6.4e-06 4.18e-05 ] [ 5.4e-06 1.1e-06 1e-06 ] [ 3.9e-06 1.03e-05 -1.3e-05 ] [ -1.4e-06 -1.87e-05 1.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.819830852608e-14 1.249697764224e-14 -5.6076181728e-14 ] [ -1.313784829056e-14 9.45284206272e-15 -1.618198387008e-14 ] [ -2.787787320192e-14 -1.025393037312e-14 6.697098274944e-14 ] [ 8.65175375232e-15 1.76239428288e-15 1.6021766208e-15 ] [ 6.24848882112e-15 1.650241919424e-14 -2.08282960704e-14 ] [ -2.24304726912e-15 -2.996070280896e-14 2.435308463616e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.784895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.169889621398282e-18 } }