{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.316837 2.864638 1.901515 ] [ 3.52699 0.8132212 1.584521 ] [ 4.498469 2.850966 1.401087 ] [ 3.329161 3.035367 4.525662 ] [ 4.789001 1.444676 3.549999 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.316837e-10 2.864638e-10 1.901515e-10 ] [ 3.52699e-10 8.132212e-11 1.584521e-10 ] [ 4.498469e-10 2.850966e-10 1.401087e-10 ] [ 3.329161e-10 3.035367e-10 4.525662e-10 ] [ 4.789001e-10 1.444676e-10 3.549999e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2439987 -0.0648675 2.5678099 ] [ -0.2714289 0.1003818 0.6722174 ] [ 1.0901941 -0.1851255 1.1059565 ] [ -0.548882 -0.7469491 -3.2679701 ] [ -0.5138818 0.8965603 -1.0780138 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.909290126455929e-10 -1.03929191949744e-10 4.114084988438786e-09 ] [ -4.348770377894611e-10 1.608293731138214e-10 1.077011002374962e-09 ] [ 1.746683499154097e-09 -2.966037480139104e-10 1.771937647921795e-09 ] [ -8.794059079779457e-10 -1.196744384947601e-09 -5.235865291693438e-09 ] [ -8.233294058146215e-10 1.436447951797434e-09 -1.727168507259767e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.705894 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.9970146037963e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2633549 2.3257157 2.4577425 ] [ 3.7062325 0.9073801 1.2526754 ] [ 4.564766 3.0305623 1.8011189 ] [ 3.6779484 3.4961622 3.9324428 ] [ 4.2481563 1.2490479 3.5188044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2633549e-10 2.3257157e-10 2.4577425e-10 ] [ 3.7062325e-10 9.073801e-11 1.2526754e-10 ] [ 4.564766e-10 3.0305623e-10 1.8011189e-10 ] [ 3.6779484e-10 3.4961622e-10 3.9324428e-10 ] [ 4.2481563e-10 1.2490479e-10 3.5188044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.6e-06 -8.2e-06 1.16e-05 ] [ 8.1e-06 1.76e-05 6.1e-06 ] [ 5.1e-06 -6e-06 2.3e-06 ] [ 4.1e-06 -2.6e-06 -1.62e-05 ] [ -8.7e-06 -8e-07 -3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.377871893888e-14 -1.313784829056e-14 1.858524880128e-14 ] [ 1.297763062848e-14 2.819830852608e-14 9.77327738688e-15 ] [ 8.17110076608e-15 -9.6130597248e-15 3.68500622784e-15 ] [ 6.568924145279999e-15 -4.16565921408e-15 -2.595526125696e-14 ] [ -1.393893660096e-14 -1.28174129664e-15 -6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }