{ "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" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.06775 -10.7826879 -14.1652709 ] [ -11.1599402 7.7068691 15.4851737 ] [ 2.6494243 -6.4391013 -0.1715953 ] [ 4.3870478 7.5928542 -9.8211048 ] [ 4.191218 1.9220659 8.6727974 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.085474669535e-10 -1.727577060509453e-08 -2.269526605026015e-08 ] [ -1.788019542527728e-08 1.234776559331661e-08 2.480998347557133e-08 ] [ 4.244845707011806e-09 -1.031657764681902e-08 -2.749259801642201e-10 ] [ 7.028825477401105e-09 1.216509358460876e-08 -1.573514463062524e-08 ] [ 6.715071547600212e-09 3.07948907398818e-09 1.389535334569595e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.3298844 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13070971160111e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4914478 0.8051985 0.6000069 ] [ -0.4343215 1.4751594 2.1831598 ] [ 2.5119603 -0.292077 1.8924755 ] [ 2.0790431 2.8890457 0.2931967 ] [ 1.8934145 2.0909308 2.7779262 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.914478e-11 8.051985e-11 6.000069e-11 ] [ -4.343215000000001e-11 1.4751594e-10 2.1831598e-10 ] [ 2.5119603e-10 -2.92077e-11 1.8924755e-10 ] [ 2.0790431e-10 2.8890457e-10 2.931967e-11 ] [ 1.8934145e-10 2.0909308e-10 2.7779262e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.73e-05 -2e-05 -0.0001054 ] [ -3.8e-06 1.28e-05 9.68e-05 ] [ -1.45e-05 6.57e-05 1.8e-06 ] [ 1.98e-05 -4.57e-05 2.47e-05 ] [ -1.88e-05 -1.28e-05 -1.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.77176557682e-14 -3.204353268e-14 -1.688694172236e-13 ] [ -6.088271209199999e-15 2.05078609152e-14 1.550906981712e-13 ] [ -2.3231561193e-14 1.052630048538e-13 2.8839179412e-15 ] [ 3.17230973532e-14 -7.32194721738e-14 3.95737628598e-14 ] [ -3.012092071919999e-14 -2.05078609152e-14 -2.86789617486e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.64318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.865443094145612e-18 } }