{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.1060157e-10 3.6275707e-10 1.9129709e-10 ] [ 4.1508795e-10 2.5691059e-10 2.4584778e-10 ] [ 4.0397088e-10 4.0510304e-10 6.179877000000001e-11 ] ] "source-value" [ [ 2.1060157 3.6275707 1.9129709 ] [ 4.1508795 2.5691059 2.4584778 ] [ 4.0397088 4.0510304 0.6179877 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.413435408339898e-10 -2.635147953528384e-11 -2.180530337376384e-11 ] [ -8.150608927099969e-11 8.97435201491808e-11 -8.219967153014402e-11 ] [ -5.983745156299008e-11 -6.339204061389697e-11 1.040048146862458e-10 ] ] "source-value" [ [ 0.0882197 -0.0164473 -0.0136098 ] [ -0.0508721 0.0560135 -0.051305 ] [ -0.0373476 -0.0395662 0.0649147 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.085546245843417e-18 "source-value" -6.7754468 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 9.186422521153651e-09 -3.140628428901963e-09 3.981734144542022e-10 ] [ -7.133047168892776e-09 4.864228568391884e-09 -3.392872552598122e-09 ] [ -2.053375352260875e-09 -1.723600139489921e-09 2.994698977926257e-09 ] ] "source-value" [ [ 5.733714 -1.9602261 0.2485203 ] [ -4.4520979 3.0360127 -2.1176645 ] [ -1.2816161 -1.0757866 1.8691441 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.965668217633344e-19 "source-value" -5.59593 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.880756e-10 3.709385000000001e-10 1.897101e-10 ] [ 4.329745e-10 2.468475e-10 2.516423e-10 ] [ 4.086103e-10 4.069847e-10 5.759124e-11 ] ] "source-value" [ [ 1.880756 3.709385 1.897101 ] [ 4.329745 2.468475 2.516423 ] [ 4.086103 4.069847 0.5759124 ] ] } "instance-id" 1 }