{ "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" [ [ 1.103512 1.466985 2.426499 ] [ 2.074865 2.595365 4.552024 ] [ 1.591542 3.438653 2.256813 ] [ 3.435088 2.328735 1.940231 ] [ 4.699457 2.544305 3.846061 ] [ 3.437343 0.6039955 3.482177 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.103512e-10 1.466985e-10 2.426499e-10 ] [ 2.074865e-10 2.595365e-10 4.552024e-10 ] [ 1.591542e-10 3.438653e-10 2.256813e-10 ] [ 3.435088e-10 2.328735e-10 1.940231e-10 ] [ 4.699457e-10 2.544305e-10 3.846061e-10 ] [ 3.437343e-10 6.039955e-11 3.482177e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8323254 -4.4048738 0.4199642 ] [ 0.0607858 0.300637 1.0598247 ] [ -0.3119438 4.4938314 -0.0500732 ] [ 2.2964938 0.5052299 -3.1448714 ] [ 0.6857356 1.0871811 1.120879 ] [ -0.898746 -1.9820056 0.5942767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.935708917578008e-09 -7.057385819934455e-09 6.728568228129754e-10 ] [ 9.738958763662464e-11 4.816735727474496e-10 1.698026356486374e-09 ] [ -4.997890633635111e-10 7.199911606896934e-09 -8.022611036864256e-11 ] [ 3.679388676172151e-09 8.094675339091219e-10 -5.038639432502565e-09 ] [ 1.09866954637026e-09 1.741856140995627e-09 1.795846128545683e-09 ] [ -1.439949829237517e-09 -3.175523034614676e-09 9.521362350261754e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.108903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.940060129013498e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1382824 1.1931397 3.1999688 ] [ 2.0373227 3.0786563 4.5529779 ] [ 1.6860627 3.3600611 2.1052251 ] [ 3.8922171 2.5981653 1.7010416 ] [ 4.2434813 2.3167697 4.1487948 ] [ 3.3444408 0.4312464 2.7957968 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1382824e-10 1.1931397e-10 3.1999688e-10 ] [ 2.0373227e-10 3.0786563e-10 4.5529779e-10 ] [ 1.6860627e-10 3.3600611e-10 2.1052251e-10 ] [ 3.8922171e-10 2.5981653e-10 1.7010416e-10 ] [ 4.2434813e-10 2.3167697e-10 4.1487948e-10 ] [ 3.3444408e-10 4.312464e-11 2.795796800000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 3.5e-06 4.8e-06 ] [ 2.5e-06 8e-07 3e-07 ] [ -3.3e-06 -3.6e-06 -4e-06 ] [ 1e-06 -3.1e-06 2.2e-06 ] [ -5.9e-06 -4.4e-06 2.7e-06 ] [ 1.2e-06 6.7e-06 -6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.2097947936e-15 5.6076181728e-15 7.69044777984e-15 ] [ 4.005441552e-15 1.28174129664e-15 4.8065298624e-16 ] [ -5.28718284864e-15 -5.76783583488e-15 -6.4087064832e-15 ] [ 1.6021766208e-15 -4.96674752448e-15 3.52478856576e-15 ] [ -9.45284206272e-15 -7.04957713152e-15 4.32587687616e-15 ] [ 1.92261194496e-15 1.073458335936e-14 -9.6130597248e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.328753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.295719306181786e-18 } }