{ "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" [ [ -2.0965881 -10.9214189 -41.8039929 ] [ -384.0993164 -1278.0410495 182.2668423 ] [ 153.4646448 35.884086 -110.0012006 ] [ 232.7312596 1253.0783823 -30.4616488 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.359104464942455e-09 -1.749804217170598e-08 -6.697738063228189e-08 ] [ -6.15394949871453e-07 -2.047647506801737e-06 2.920236758860228e-07 ] [ 2.458774680436696e-07 5.749264412164652e-08 -1.762413533132668e-07 ] [ 3.728765861325081e-07 2.007652904691579e-06 -4.880494194047414e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 293.53388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.702931238233599e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.7780164 -0.3902848 -0.264755 ] [ 0.7871932 0.5107906 2.0574204 ] [ 3.364531 3.3009204 0.4435434 ] [ 1.5332959 2.9155483 2.0874954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.780164000000001e-11 -3.902848e-11 -2.64755e-11 ] [ 7.871932000000001e-11 5.107906e-11 2.0574204e-10 ] [ 3.364531e-10 3.3009204e-10 4.435434e-11 ] [ 1.5332959e-10 2.915548300000001e-10 2.0874954e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 -2.3e-06 7.3e-06 ] [ -7e-06 -1.85e-05 -9.9e-06 ] [ 3.6e-05 1.12e-05 -3.12e-05 ] [ -2.73e-05 9.7e-06 3.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.5634826144e-15 -3.685006258199999e-15 1.16958894282e-14 ] [ -1.1215236438e-14 -2.9640267729e-14 -1.58615486766e-14 ] [ 5.7678358824e-14 1.79443783008e-14 -4.998791098079999e-14 ] [ -4.37394221082e-14 1.55411133498e-14 5.415357022919999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.40827 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.827806362836318e-18 } }