{ "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" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8601353 2.6915895 -1.4346485 ] [ 0.317526 1.1117778 -0.9119324 ] [ 12.1243114 -28.7826669 15.4487855 ] [ 3.0091753 16.0024069 -34.4529705 ] [ -12.5908774 8.9768927 21.3507659 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.582441909984795e-09 4.312401769690762e-09 -2.298560285765789e-09 ] [ 5.087327336961408e-10 1.781264398684458e-09 -1.461076771030034e-09 ] [ 1.942528826837892e-08 -4.611491599145401e-08 2.475168294785403e-08 ] [ 4.821230313548827e-09 2.563868221170861e-08 -5.519974385221209e-08 ] [ -2.017280940563909e-08 1.438256761137019e-08 3.420769796115387e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.3655304 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.187820881871672e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0637287 -0.4398096 0.9800705 ] [ 0.0177281 0.9339141 2.2796635 ] [ 2.9063723 0.5019334 0.3572091 ] [ 2.9992029 2.4576991 1.2718886 ] [ 1.213934 2.7246748 2.4600204 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0637287e-10 -4.398096e-11 9.800705e-11 ] [ 1.77281e-12 9.339141e-11 2.2796635e-10 ] [ 2.9063723e-10 5.019334e-11 3.572091e-11 ] [ 2.9992029e-10 2.4576991e-10 1.2718886e-10 ] [ 1.213934e-10 2.7246748e-10 2.4600204e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.1e-06 5.4e-06 -1.14e-05 ] [ 1.74e-05 1.65e-05 5.4e-06 ] [ -1.27e-05 3.94e-05 3.55e-05 ] [ 1.3e-06 -4.03e-05 -2.46e-05 ] [ -1.31e-05 -2.09e-05 -4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.137545400768e-14 8.65175375232e-15 -1.826481347712e-14 ] [ 2.787787320192e-14 2.64359142432e-14 8.65175375232e-15 ] [ -2.034764308416e-14 6.312575885952001e-14 5.68772700384e-14 ] [ 2.08282960704e-15 -6.456771781824e-14 -3.941354487168e-14 ] [ -2.098851373248e-14 -3.348549137472e-14 -7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.012367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.924593356786943e-18 } }