{ "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" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -35.8680074 -9.0318664 -10.3327841 ] [ -2.3731397 -1.037725 3.9821852 ] [ 0.6097641 0.2278031 0.4463658 ] [ 26.9937693 -11.3886287 12.6774631 ] [ 10.6376137 21.2304171 -6.7732299 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.746688336441909e-08 -1.44706453074897e-08 -1.655494524918672e-08 ] [ -3.802188976557769e-09 -1.66261874751765e-09 6.380164079700616e-09 ] [ 9.769497932720394e-10 3.649808039727653e-10 7.151568549767171e-10 ] [ 4.324878643604653e-08 -1.824659479644179e-08 2.03115351572172e-08 ] [ 1.704333611165828e-08 3.401487820769404e-08 -1.085191068249015e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.7056186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.141408803435792e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4162731 1.3511765 0.2536141 ] [ 2.1641157 2.4457526 2.7739353 ] [ 0.7115443 3.8288974 0.9954496 ] [ 3.8735714 1.0261297 1.2744342 ] [ 3.2972929 3.4856209 0.3772825 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4162731e-10 1.3511765e-10 2.536141e-11 ] [ 2.1641157e-10 2.4457526e-10 2.7739353e-10 ] [ 7.115443e-11 3.8288974e-10 9.954496e-11 ] [ 3.8735714e-10 1.0261297e-10 1.2744342e-10 ] [ 3.2972929e-10 3.4856209e-10 3.772825000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.4e-06 1.8e-05 7.3e-06 ] [ -2.1e-06 -8.8e-06 -1.13e-05 ] [ 1.13e-05 -1.2e-05 3e-07 ] [ -1.4e-06 1.65e-05 5e-06 ] [ -4.4e-06 -1.37e-05 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.4474005556e-15 2.8839179412e-14 1.16958894282e-14 ] [ -3.364570931399999e-15 -1.40991543792e-14 -1.81045959642e-14 ] [ 1.81045959642e-14 -1.9226119608e-14 4.806529901999999e-16 ] [ -2.2430472876e-15 2.6435914461e-14 8.010883169999999e-15 ] [ -7.0495771896e-15 -2.19498198858e-14 -2.0828296242e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.907624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.548682347525762e-18 } }