{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.0759888e-10 2.3459388e-10 7.79909e-11 ] [ 4.4397375e-10 1.4344041e-10 3.9533983e-10 ] [ 1.1537998e-10 5.109074500000001e-10 2.4436873e-10 ] [ 1.8635108e-10 4.2850083e-10 4.3599231e-10 ] [ 4.0576806e-10 7.008526e-11 1.8830411e-10 ] [ 3.0075255e-10 4.4636853e-10 1.4070875e-10 ] [ 3.7706819e-10 3.2957895e-10 4.9360297e-10 ] ] "source-value" [ [ 3.0759888 2.3459388 0.779909 ] [ 4.4397375 1.4344041 3.9533983 ] [ 1.1537998 5.1090745 2.4436873 ] [ 1.8635108 4.2850083 4.3599231 ] [ 4.0576806 0.7008526 1.8830411 ] [ 3.0075255 4.4636853 1.4070875 ] [ 3.7706819 3.2957895 4.9360297 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.339135909509256e-09 1.794532343716627e-10 5.287232516115244e-10 ] [ -6.98306757563735e-10 -8.790790639473024e-10 -3.660049763488447e-09 ] [ 1.556209052025613e-09 2.131269814993268e-10 -8.49101538283824e-10 ] [ 3.958171413632903e-09 -1.764887269701965e-09 2.422174941202316e-09 ] [ 2.058809775140967e-10 2.584040602154471e-09 4.005285660214797e-09 ] [ -2.329001481343327e-09 -8.830375617243131e-10 -8.072538064721625e-10 ] [ -4.032089113774808e-09 5.503830773481197e-10 -1.639778584566541e-09 ] ] "source-value" [ [ 0.8358229 0.1120059 0.3300031 ] [ -0.4358488 -0.548678 -2.2844234 ] [ 0.9713093 0.1330234 -0.5299675 ] [ 2.4704963 -1.101556 1.5118027 ] [ 0.1285008 1.6128313 2.4999027 ] [ -1.4536484 -0.5511487 -0.5038482 ] [ -2.5166321 0.3435221 -1.0234693 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "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" -2.69981164172621e-18 "source-value" -16.850899 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.054329676890243e-08 1.534973290397011e-08 5.695219262371847e-09 ] [ 8.03543950484934e-09 4.648087732451171e-09 -4.764275017508993e-09 ] [ 9.048248406110928e-09 -8.37488609657409e-09 1.898523091292142e-08 ] [ -7.962342599790272e-09 8.08281074056121e-09 -1.900290147908989e-08 ] [ -5.114176452555112e-09 -1.101145550120045e-09 5.368128816964368e-09 ] [ -1.162920273544075e-08 -1.50576577081749e-08 -5.677548696203382e-09 ] [ -2.921262892076565e-09 -3.546942342548788e-09 -6.038539596730368e-10 ] ] "source-value" [ [ 6.5806083 9.5805498 3.5546763 ] [ 5.0153269 2.9011082 -2.9736266 ] [ 5.6474725 -5.2271928 11.8496492 ] [ -4.9697034 5.0448937 -11.8606783 ] [ -3.1920179 -0.687281 3.3505225 ] [ -7.2583775 -9.3982508 -3.5436472 ] [ -1.8233089 -2.2138273 -0.376896 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.190318711413987e-18 "source-value" -7.4293851 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] "source-value" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] } "instance-id" 1 }