{ "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" [ [ 2.096068 2.7039 2.040826 ] [ 2.700744 4.841018 2.002574 ] [ 4.164753 1.488214 0.9121723 ] [ 3.472077 2.802445 4.029704 ] [ 4.572692 3.360808 2.141211 ] [ 3.154153 3.397307 0.264031 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.096068e-10 2.7039e-10 2.040826e-10 ] [ 2.700744e-10 4.841018000000001e-10 2.002574e-10 ] [ 4.164753e-10 1.488214e-10 9.121723000000001e-11 ] [ 3.472077e-10 2.802445e-10 4.029704e-10 ] [ 4.572692e-10 3.360808e-10 2.141211e-10 ] [ 3.154153e-10 3.397307e-10 2.64031e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8608916 -1.8768557 1.4657377 ] [ 0.2752135 1.1504836 0.5338405 ] [ -0.1370648 -0.8318941 0.1399044 ] [ -0.5927773 0.0435327 -0.0746518 ] [ 1.0489235 0.6576635 0.1918081 ] [ 0.2665968 0.8570701 -2.2566389 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.379300405926874e-09 -3.007054347929713e-09 2.348370694512902e-09 ] [ 4.40940639061359e-10 1.843277941720202e-09 8.553067753828769e-10 ] [ -2.196020199038832e-10 -1.332841288982459e-09 2.241515606737896e-10 ] [ -9.497339392256082e-10 6.97470747549318e-11 -1.196053696460412e-10 ] [ 1.680560722553499e-09 1.053693092734659e-09 3.073104560319354e-10 ] [ 4.271351636591712e-10 1.373177687920043e-09 -3.615534116955462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.8699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.54263829639166e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7569931 2.4968112 1.879651 ] [ 2.7701324 4.6572579 2.2939523 ] [ 3.9500292 1.5406393 1.5028867 ] [ 3.4820735 2.7222314 3.5645575 ] [ 4.9631694 3.7010856 1.9171887 ] [ 3.2380893 3.4756666 0.2322821 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7569931e-10 2.4968112e-10 1.879651e-10 ] [ 2.7701324e-10 4.657257900000001e-10 2.2939523e-10 ] [ 3.9500292e-10 1.5406393e-10 1.5028867e-10 ] [ 3.4820735e-10 2.7222314e-10 3.5645575e-10 ] [ 4.9631694e-10 3.7010856e-10 1.9171887e-10 ] [ 3.2380893e-10 3.4756666e-10 2.322821e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 8e-07 -6e-07 ] [ -4e-07 1.8e-06 2e-07 ] [ 2.3e-06 -1.4e-06 1.2e-06 ] [ 1e-07 -2.2e-06 1.4e-06 ] [ 1.7e-06 8e-07 -3e-07 ] [ -1.4e-06 1e-07 -2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.685006258199999e-15 1.2817413072e-15 -9.613059803999998e-16 ] [ -6.408706536e-16 2.8839179412e-15 3.204353268e-16 ] [ 3.685006258199999e-15 -2.2430472876e-15 1.9226119608e-15 ] [ 1.602176634e-16 -3.5247885948e-15 2.2430472876e-15 ] [ 2.7237002778e-15 1.2817413072e-15 -4.806529901999999e-16 ] [ -2.2430472876e-15 1.602176634e-16 -3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.290227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.770199769595592e-18 } }