{ "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" [ [ 2.273702 2.402034 1.908702 ] [ 1.908149 2.590409 4.360855 ] [ 2.360817 4.517724 2.766871 ] [ 3.26801 0.6931896 3.511788 ] [ 4.292326 2.985376 3.423625 ] [ 4.772846 4.542174 1.540942 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.273702e-10 2.402034e-10 1.908702e-10 ] [ 1.908149e-10 2.590409e-10 4.360855e-10 ] [ 2.360817e-10 4.517724e-10 2.766871e-10 ] [ 3.26801e-10 6.931896e-11 3.511788e-10 ] [ 4.292326e-10 2.985376e-10 3.423625e-10 ] [ 4.772846e-10 4.542174e-10 1.540942e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3046757 11.4406017 5.6994649 ] [ 1.3919161 -1.8006001 -1.8592979 ] [ -0.4672603 -11.3551099 -4.607747 ] [ -1.2293314 1.7151083 0.7675799 ] [ 0.2739553 0.8875656 -1.07336 ] [ -0.2739553 -0.8875656 1.07336 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.881442834658745e-10 1.832986457162474e-08 9.131549413850209e-09 ] [ 2.230095433535115e-09 -2.884879383630142e-09 -2.978923626482536e-09 ] [ -7.486335284879943e-10 -1.819289160839463e-08 -7.382424517961338e-09 ] [ -1.969606028295333e-09 2.747906420400033e-09 1.229798570376002e-09 ] [ 4.389247768042503e-10 1.422036853746325e-09 -1.719712297701888e-09 ] [ -4.389247768042503e-10 -1.422036853746325e-09 1.719712297701888e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.3527463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.769515116533703e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3848263 3.3990561 2.5621077 ] [ 2.0056649 1.5889789 3.6653159 ] [ 2.4623122 5.1069999 1.6765452 ] [ 3.4609922 0.0838876 4.3377271 ] [ 4.968045 2.9120415 3.2891758 ] [ 4.5940094 4.6399426 1.9819113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3848263e-10 3.3990561e-10 2.5621077e-10 ] [ 2.0056649e-10 1.5889789e-10 3.6653159e-10 ] [ 2.4623122e-10 5.1069999e-10 1.6765452e-10 ] [ 3.4609922e-10 8.388760000000001e-12 4.337727100000001e-10 ] [ 4.968045000000001e-10 2.9120415e-10 3.2891758e-10 ] [ 4.5940094e-10 4.639942600000001e-10 1.9819113e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0855057 -0.7807169 0.517661 ] [ -0.4888703 0.8874397 -0.5746886 ] [ -0.2712498 0.0027021 -0.1123005 ] [ 0.0297452 -0.0882904 0.0539516 ] [ 0.5346773 -0.2764307 0.1979145 ] [ 0.1101918 0.2552962 -0.0825379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.369952334851386e-10 -1.250846364643452e-09 8.293843516999489e-10 ] [ -7.832565652634822e-10 1.421835139709766e-09 -9.207526391602829e-10 ] [ -4.345900879566758e-10 4.32924144706368e-12 -1.799252356041504e-10 ] [ 4.765706402102016e-11 -1.414568147210803e-10 8.643999217475329e-11 ] [ 8.566474697324679e-10 -4.428908048113785e-10 3.170939848173216e-10 ] [ 1.765467257638694e-10 4.090296030190809e-10 -1.322402937099283e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.890996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.065365241002632e-18 } }