{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.457406 2.100076 2.252169 ] [ 2.703043 4.198802 1.427674 ] [ 1.54274 3.831579 3.120531 ] [ 4.586348 2.503005 1.027399 ] [ 4.020521 2.853252 3.469677 ] [ 5.359849 4.671518 1.954564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.457406e-10 2.100076e-10 2.252169e-10 ] [ 2.703043e-10 4.198802e-10 1.427674e-10 ] [ 1.54274e-10 3.831579e-10 3.120531e-10 ] [ 4.586348e-10 2.503005e-10 1.027399e-10 ] [ 4.020521e-10 2.853252e-10 3.469677e-10 ] [ 5.359849e-10 4.671518e-10 1.954564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.560946 -17.5415079 -2.2331138 ] [ -5.0357404 12.5364281 -12.346778 ] [ -15.4557392 6.7970194 10.6860995 ] [ 9.6373382 -8.8900562 -11.9348634 ] [ 8.7633178 -3.4175066 16.1253059 ] [ 11.6517696 10.5156233 -0.2966501 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.531832415393128e-08 -2.81045938509585e-08 -3.577842721945847e-09 ] [ -8.06814553729804e-09 2.008557201016017e-08 -1.978171905380778e-08 ] [ -2.47628240034221e-08 1.089002557380404e-08 1.712101878644257e-08 ] [ 1.544071795078276e-08 -1.424344020123809e-08 -1.91217591119216e-08 ] [ 1.404038289980049e-08 -5.475449175949698e-09 2.58355881162283e-08 ] [ 1.866819284406817e-08 1.684788580439974e-08 -4.752858547779821e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 113.70025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.821678823291152e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.8231349 -2.557396 1.7666463 ] [ 0.6310872 7.0443732 -2.857935 ] [ -2.34787 6.0435187 6.6354365 ] [ 7.8732473 -0.0968259 -2.5133685 ] [ 6.2212399 1.073822 8.0352758 ] [ 9.1153375 8.6507401 2.1859589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.231349000000001e-11 -2.557396e-10 1.7666463e-10 ] [ 6.310872e-11 7.044373200000001e-10 -2.857935e-10 ] [ -2.34787e-10 6.0435187e-10 6.6354365e-10 ] [ 7.8732473e-10 -9.682590000000001e-12 -2.5133685e-10 ] [ 6.2212399e-10 1.073822e-10 8.035275800000001e-10 ] [ 9.115337500000001e-10 8.650740100000001e-10 2.1859589e-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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }