{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4267055 -12.3759964 2.557681 ] [ -6.0061863 10.9288334 -4.2067941 ] [ -7.5638757 -4.2218386 1.3945761 ] [ 1.5087454 -1.2383219 -4.5827511 ] [ 0.9400649 3.1093062 7.3003234 ] [ 0.219614 -1.9515433 0.1705395 ] [ 9.4749322 5.7495607 -2.6335748 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.285834215699287e-09 -1.982853225454811e-08 4.097856735425754e-09 ] [ -9.622971349310913e-09 1.750992151035878e-08 -6.740027211069059e-09 ] [ -1.211866490902039e-08 -6.764131157439272e-09 2.234357241754847e-09 ] [ 2.417276626534983e-09 -1.984010413550485e-09 -7.342376731857797e-09 ] [ 1.506150017223546e-09 4.981657741591331e-09 1.169640757212343e-08 ] [ 3.518604192992759e-10 -3.126717075499252e-09 2.732344020740429e-10 ] [ 1.518051497957421e-08 9.211811809304683e-09 -4.219452008451222e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.542276 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650364808037899e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7543883 1.9847148 3.4898066 ] [ 1.71965 5.4024085 2.1536308 ] [ 0.7817706 3.276197 2.8773674 ] [ 2.5836529 3.2568137 1.062651 ] [ 2.4791763 4.4336616 4.3846873 ] [ 4.6797305 2.7176212 2.1948269 ] [ 4.116269 5.0721862 2.43892 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7543883e-10 1.9847148e-10 3.4898066e-10 ] [ 1.71965e-10 5.4024085e-10 2.1536308e-10 ] [ 7.817706e-11 3.276197e-10 2.8773674e-10 ] [ 2.5836529e-10 3.2568137e-10 1.062651e-10 ] [ 2.4791763e-10 4.4336616e-10 4.384687300000001e-10 ] [ 4.6797305e-10 2.7176212e-10 2.1948269e-10 ] [ 4.116269e-10 5.0721862e-10 2.43892e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-05 1.43e-05 1.1e-05 ] [ 1.3e-06 4e-07 1.9e-06 ] [ 1.85e-05 -1.93e-05 -2.83e-05 ] [ -6.6e-06 4.48e-05 8.68e-05 ] [ -1.2e-05 -2.25e-05 -2.58e-05 ] [ 1.2e-05 -2.38e-05 -1.3e-05 ] [ -2e-07 6.1e-06 -3.26e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.082829624199999e-14 2.29111258662e-14 1.7623942974e-14 ] [ 2.0828296242e-15 6.408706536e-16 3.0441356046e-15 ] [ 2.9640267729e-14 -3.09220090362e-14 -4.53415987422e-14 ] [ -1.05743657844e-14 7.177751320319999e-14 1.390689318312e-13 ] [ -1.9226119608e-14 -3.6048974265e-14 -4.133615715719999e-14 ] [ 1.9226119608e-14 -3.81318038892e-14 -2.082829624199999e-14 ] [ -3.204353268e-16 9.773277467399999e-15 -5.22309582684e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.095233 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.540046603538572e-18 } }