{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.888839 2.682802 2.483288 ] [ 4.584027 1.697115 1.780244 ] [ 5.622084 2.160801 4.094107 ] [ 3.250182 0.9950144 3.979579 ] [ 5.691266 3.575432 2.207922 ] [ 3.710937 3.502612 1.042458 ] [ 3.524601 3.924526 3.14177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.888839e-10 2.682802e-10 2.483288e-10 ] [ 4.584027e-10 1.697115e-10 1.780244e-10 ] [ 5.622084000000001e-10 2.160801e-10 4.094107000000001e-10 ] [ 3.250182e-10 9.950144e-11 3.979579e-10 ] [ 5.691266e-10 3.575432e-10 2.207922e-10 ] [ 3.710937e-10 3.502612e-10 1.042458e-10 ] [ 3.524601e-10 3.924526e-10 3.14177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.6619425 -2.0301888 -1.4339073 ] [ 5.0587846 -16.83984 -10.3096404 ] [ 11.9139834 -4.0764199 13.586564 ] [ -6.0255594 -12.6270575 9.987463 ] [ 18.1533292 10.8137864 -3.7042841 ] [ -4.7713025 8.7822704 -20.0331365 ] [ -4.6672929 15.9774493 11.9069413 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.15019045930139e-08 -3.252721031170007e-09 -2.297372752454452e-09 ] [ 8.105066415783081e-09 -2.698039794601267e-08 -1.651786481773516e-08 ] [ 1.908830566407929e-08 -6.531144660343874e-09 2.176807519780293e-08 ] [ -9.654010397921676e-09 -2.02307763159973e-08 1.600167971970503e-08 ] [ 2.908483963392597e-08 1.7325595752405e-08 -5.93491738182117e-09 ] [ -7.644469316264592e-09 1.407074831242386e-08 -3.209662294159514e-08 ] [ -7.477827566805831e-09 2.559869572847733e-08 1.907702297609796e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 150.6475 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.41363902481968e-17 } "relaxed-configuration-positions" { "source-value" [ [ -4.4124812 2.2801595 1.5124258 ] [ 6.1291942 -2.4782965 -1.1004493 ] [ 9.7775852 1.0579242 8.5888609 ] [ 0.9454727 -3.5338611 7.6352921 ] [ 10.9757494 6.8212508 0.5050212 ] [ 2.3994124 6.2936875 -4.6104571 ] [ 2.4570034 8.097438 6.1986745 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.412481200000001e-10 2.2801595e-10 1.5124258e-10 ] [ 6.1291942e-10 -2.4782965e-10 -1.1004493e-10 ] [ 9.777585200000002e-10 1.0579242e-10 8.588860900000001e-10 ] [ 9.454727000000001e-11 -3.5338611e-10 7.6352921e-10 ] [ 1.09757494e-09 6.8212508e-10 5.050212e-11 ] [ 2.3994124e-10 6.2936875e-10 -4.6104571e-10 ] [ 2.4570034e-10 8.097438000000001e-10 6.198674500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }