{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2966572 -11.0123081 -13.4661701 ] [ -16.4072164 -44.9135559 15.8267077 ] [ 17.5347798 9.5538662 -11.5433548 ] [ 2.1690939 46.3719978 9.1828173 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28182709263199e-09 -1.764366257886647e-08 -2.1575182905936e-08 ] [ -2.628725852848634e-08 -7.19594492199739e-08 2.535718106117534e-08 ] [ 2.80938142464361e-08 1.530698106389134e-08 -1.849449318615946e-08 ] [ 3.475271534899893e-09 7.429613073494905e-08 1.471249519113778e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.800069 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.890579467562684e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.794524 -0.2361794 -0.1889137 ] [ 0.8922139 0.5685373 2.0186298 ] [ 3.277801 3.1639913 0.4953473 ] [ 1.4984977 2.8406253 1.9986407 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.945240000000001e-11 -2.361794e-11 -1.889137e-11 ] [ 8.922139e-11 5.685373e-11 2.0186298e-10 ] [ 3.277801e-10 3.1639913e-10 4.953473e-11 ] [ 1.4984977e-10 2.8406253e-10 1.9986407e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.4e-06 1.89e-05 1.26e-05 ] [ 2.2e-05 -8e-07 -1.85e-05 ] [ -4.26e-05 -3.62e-05 2.95e-05 ] [ 1.62e-05 1.8e-05 -2.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.04957713152e-15 3.028113813312e-14 2.018742542208e-14 ] [ 3.52478856576e-14 -1.28174129664e-15 -2.96402674848e-14 ] [ -6.825272404608e-14 -5.799879367296e-14 4.72642103136e-14 ] [ 2.595526125696e-14 2.88391791744e-14 -3.781136825088e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.9449997 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.112711615080302e-18 } }