{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.9014917 -1.8003834 -6.04577 ] [ -4.541141 -2.555379 9.5624171 ] [ 7.2505069 -7.7781028 -3.9664489 ] [ -0.3687525 10.7388749 0.1927616 ] [ 3.5608783 1.3949902 0.2570401 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.455232029585248e-09 -2.884532191956415e-09 -9.686391348734016e-09 ] [ -7.275709941956332e-09 -4.094168491083283e-09 1.532068111595814e-08 ] [ 1.161659264412908e-08 -1.246189446033902e-08 -6.354951695177877e-09 ] [ -5.908066343615521e-10 1.720557429847594e-08 3.088381289080013e-10 ] [ 5.705155961774049e-09 2.235020684685116e-09 4.118236388280941e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 0.018705473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.996947152160564e-21 } "relaxed-configuration-positions" { "source-value" [ [ 1.1624439 0.7679184 0.7700076 ] [ 0.5303023 2.5259137 2.2173781 ] [ 3.443747 1.0557987 0.2242882 ] [ 2.4209342 3.9002671 2.5662213 ] [ 4.2215387 2.9916951 1.3344127 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1624439e-10 7.679184e-11 7.700076e-11 ] [ 5.303023e-11 2.5259137e-10 2.2173781e-10 ] [ 3.443747e-10 1.0557987e-10 2.242882e-11 ] [ 2.4209342e-10 3.9002671e-10 2.5662213e-10 ] [ 4.2215387e-10 2.9916951e-10 1.3344127e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 2.5e-06 1.4e-06 ] [ 2.8e-06 -4.4e-06 -2.7e-06 ] [ 1.6e-06 3.7e-06 2.6e-06 ] [ 4e-06 7e-07 -1.8e-06 ] [ -6.1e-06 -2.5e-06 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 4.005441552e-15 2.24304726912e-15 ] [ 4.48609453824e-15 -7.04957713152e-15 -4.32587687616e-15 ] [ 2.56348259328e-15 5.928053496960001e-15 4.16565921408e-15 ] [ 6.4087064832e-15 1.12152363456e-15 -2.88391791744e-15 ] [ -9.77327738688e-15 -4.005441552e-15 8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.0960126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.136906548862222e-18 } }