{ "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" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2654102 -2.60588 -1.5182916 ] [ -10.0581572 2.817977 -0.5021829 ] [ -7.6999325 -1.4458173 4.649703 ] [ 1.6176479 -0.3465338 2.9775837 ] [ 16.3069672 4.0355372 -12.3106391 ] [ -0.4319356 -2.455283 6.7038269 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.252340208652667e-10 -4.17508004700792e-09 -2.432571325118474e-09 ] [ -1.611494444693886e-08 4.514896904549418e-09 -8.045857083743585e-10 ] [ -1.23366519348772e-08 -2.316454695092968e-09 7.449645501639701e-09 ] [ 2.591757667419168e-09 -5.552083572512291e-10 4.770615029919266e-09 ] [ 2.61266418192444e-08 6.465643407477784e-09 -1.972381831562679e-08 ] [ -6.920371257127703e-10 -3.933797052457422e-09 1.074071481756065e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.9349166 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.111096133525872e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.112371 -0.1763669 0.0711902 ] [ 0.1945711 2.8726416 0.8244157 ] [ -0.2664723 1.5456391 2.2887491 ] [ 1.6604459 0.254652 2.5413 ] [ 2.3889929 2.3515854 0.2273664 ] [ 3.3498842 2.1614316 2.5793845 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.112371e-10 -1.763669e-11 7.11902e-12 ] [ 1.945711e-11 2.8726416e-10 8.244157e-11 ] [ -2.664723e-11 1.5456391e-10 2.2887491e-10 ] [ 1.6604459e-10 2.54652e-11 2.5413e-10 ] [ 2.3889929e-10 2.3515854e-10 2.273664e-11 ] [ 3.3498842e-10 2.1614316e-10 2.5793845e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.1e-06 -1.6e-06 -6e-07 ] [ 1.13e-05 -8.1e-06 6e-07 ] [ -1.3e-05 1e-06 -8e-06 ] [ 8.3e-06 -3.7e-06 6.3e-06 ] [ -5.7e-06 1.02e-05 -2.8e-06 ] [ 8.2e-06 2.2e-06 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.45798073694e-14 -2.5634826144e-15 -9.613059803999998e-16 ] [ 1.81045959642e-14 -1.29776307354e-14 9.613059803999998e-16 ] [ -2.082829624199999e-14 1.602176634e-15 -1.2817413072e-14 ] [ 1.32980660622e-14 -5.9280535458e-15 1.00937127942e-14 ] [ -9.1324068138e-15 1.63422016668e-14 -4.486094575199999e-15 ] [ 1.31378483988e-14 3.5247885948e-15 7.0495771896e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.314433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453642671555852e-18 } }