{ "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" [ [ 0.7481215 0.3697243 2.264709 ] [ 0.2413431 2.204484 1.035234 ] [ 2.632044 0.6504598 2.339521 ] [ 2.588426 1.874203 0.0457334 ] [ 2.842468 2.848588 2.160611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.481215e-11 3.697243e-11 2.264709e-10 ] [ 2.413431e-11 2.204484e-10 1.035234e-10 ] [ 2.632044e-10 6.504598e-11 2.339521e-10 ] [ 2.588426e-10 1.874203e-10 4.57334e-12 ] [ 2.842468e-10 2.848588e-10 2.160611e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -149.6703022 -21.9540823 -3.6685153 ] [ -0.4938592 -4.3016809 -11.3159791 ] [ 144.2375588 -6.5599187 -36.2718716 ] [ -17.2097047 -49.1949347 -9.5553876 ] [ 23.1363073 82.0106165 60.8117536 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.397982590129108e-07 -3.517431739217909e-08 -5.877609446707098e-09 ] [ -7.912496642069913e-10 -6.892052568121903e-09 -1.813019715548142e-08 ] [ 2.310940445506253e-07 -1.051014837548873e-08 -5.811394467017949e-08 ] [ -2.757298652121188e-08 -7.881897423812266e-08 -1.530941861540222e-08 ] [ 3.706845064770437e-08 1.313954924136947e-07 9.743116988777024e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 45.036594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.215657798726157e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3620451 0.1577855 2.4206416 ] [ 0.1872722 2.6227552 0.9373749 ] [ 3.2352216 0.3600299 2.3175704 ] [ 2.6430026 1.5630605 -0.3126654 ] [ 2.6248612 3.2438279 2.4828869 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.620451e-11 1.577855e-11 2.4206416e-10 ] [ 1.872722e-11 2.6227552e-10 9.373749e-11 ] [ 3.2352216e-10 3.600299000000001e-11 2.3175704e-10 ] [ 2.6430026e-10 1.5630605e-10 -3.126654e-11 ] [ 2.6248612e-10 3.2438279e-10 2.4828869e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.69e-05 -0.0 -3.81e-05 ] [ 1.41e-05 -2.56e-05 2.12e-05 ] [ 1.93e-05 -7.9e-06 1.08e-05 ] [ -2.31e-05 -1.8e-06 1.63e-05 ] [ 1.67e-05 3.53e-05 -1.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.309855109952001e-14 0.0 -6.104292925248e-14 ] [ 2.259069035328e-14 -4.101572149248001e-14 3.396614436096001e-14 ] [ 3.092200878144e-14 -1.265719530432e-14 1.730350750464e-14 ] [ -3.701027994048e-14 -2.88391791744e-15 2.611547891904e-14 ] [ 2.675634956736e-14 5.655683471424e-14 -1.634220153216e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }