{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.145285 -3.8041151 -7.342358 ] [ -22.5247765 5.0720835 7.9690293 ] [ 13.2652012 -13.5111308 1.5469878 ] [ 2.6606508 -0.7659105 -31.8703309 ] [ 8.7442095 13.0090728 29.6966718 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.437125471952928e-09 -6.094864276052255e-09 -1.176375432914385e-08 ] [ -3.608867029704526e-08 8.126373602445436e-09 1.276779243493019e-08 ] [ 2.125319523284811e-08 -2.16472178883308e-08 2.478547685822826e-09 ] [ 4.262832507872817e-09 -1.227123896725238e-09 -5.106189906513982e-08 ] [ 1.400976802827726e-08 2.08428322984452e-08 4.757931327353065e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.8658378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.398108184564907e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5211499 0.83663 0.7373138 ] [ -0.407155 1.4620515 3.0452512 ] [ 1.7249419 -0.018856 2.8345702 ] [ 1.8570629 2.8085807 0.3956459 ] [ 1.9062619 2.5393142 2.7862613 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.211499000000001e-11 8.3663e-11 7.373138000000001e-11 ] [ -4.07155e-11 1.4620515e-10 3.0452512e-10 ] [ 1.7249419e-10 -1.8856e-12 2.8345702e-10 ] [ 1.8570629e-10 2.8085807e-10 3.956459e-11 ] [ 1.9062619e-10 2.5393142e-10 2.7862613e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 3.87e-05 2.3e-06 ] [ -5.7e-06 -1.47e-05 9.9e-06 ] [ -3.1e-06 -3.74e-05 2.53e-05 ] [ -1.9e-06 1.4e-06 -3.33e-05 ] [ -4.8e-06 1.2e-05 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.48337376224e-14 6.200423522496e-14 3.68500622784e-15 ] [ -9.13240673856e-15 -2.355199632576e-14 1.586154854592e-14 ] [ -4.96674752448e-15 -5.992140561792e-14 4.053506850624e-14 ] [ -3.04413557952e-15 2.24304726912e-15 -5.335248147264001e-14 ] [ -7.69044777984e-15 1.92261194496e-14 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.744302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.721426947121468e-18 } }