{ "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" [ [ 0.0562169 0.1968178 1.270009 ] [ 0.319021 0.1442605 2.935142 ] [ 0.1524012 2.469722 2.823059 ] [ 2.088827 0.2993275 0.454611 ] [ 2.473305 0.2789971 2.995912 ] [ 2.138376 2.393894 2.931206 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.62169e-12 1.968178e-11 1.270009e-10 ] [ 3.19021e-11 1.442605e-11 2.935142e-10 ] [ 1.524012e-11 2.469722e-10 2.823059e-10 ] [ 2.088827e-10 2.993275e-11 4.54611e-11 ] [ 2.473305e-10 2.789971e-11 2.995912e-10 ] [ 2.138376e-10 2.393894e-10 2.931206e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.293119 1.1535283 -30.7297084 ] [ -2.3349012 -5.7571457 28.3308 ] [ -7.973991 -0.0266902 -0.9887448 ] [ 2.0582626 -0.3669085 0.3085068 ] [ 8.4957065 -2.8737331 2.0207637 ] [ 11.0480421 7.8709492 1.0583825 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.809357123771228e-08 1.848156073691169e-09 -4.923442036248137e-08 ] [ -3.740924114517865e-09 -9.22396424307925e-09 4.539094540856064e-08 ] [ -1.277574195466961e-08 -4.276241444447616e-11 -1.584143802497572e-09 ] [ 3.297700217187022e-09 -5.878522206727969e-10 4.942823823178215e-10 ] [ 1.36116223314786e-08 -4.604227987239108e-09 3.237620356301305e-09 ] [ 1.770091475823414e-08 1.261065079174446e-08 1.695715697363856e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.42223 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.349390000100039e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1561897 0.5998718 0.9502866 ] [ 0.4358113 0.0484386 3.2185017 ] [ -0.0670744 2.3285335 2.6289354 ] [ 2.05837 -0.0432366 0.6391851 ] [ 2.7656972 0.3097162 2.8257286 ] [ 2.1915326 2.5396955 3.1473016 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.561897e-11 5.998717999999999e-11 9.502866e-11 ] [ 4.358113000000001e-11 4.84386e-12 3.2185017e-10 ] [ -6.707440000000001e-12 2.3285335e-10 2.6289354e-10 ] [ 2.05837e-10 -4.32366e-12 6.391851e-11 ] [ 2.7656972e-10 3.097162e-11 2.8257286e-10 ] [ 2.1915326e-10 2.5396955e-10 3.1473016e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 -3.21e-05 -2.8e-06 ] [ -0.0001009 -4.91e-05 0.0001022 ] [ -2.56e-05 3.8e-06 -4.05e-05 ] [ 1.63e-05 1.67e-05 -0.0001177 ] [ 1.81e-05 2.08e-05 2.1e-05 ] [ 8.61e-05 3.99e-05 3.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 -5.142986952768e-14 -4.48609453824e-15 ] [ -1.6165962103872e-13 -7.866687208128001e-14 1.6374245064576e-13 ] [ -4.101572149248001e-14 6.08827115904e-15 -6.488815314240001e-14 ] [ 2.611547891904e-14 2.675634956736e-14 -1.8857618826816e-13 ] [ 2.899939683648e-14 3.332527371264e-14 3.36457090368e-14 ] [ 1.3794740705088e-13 6.392684716992e-14 6.056227626623999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.074191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.895804626007377e-18 } }