{ "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" [ [ 2.274506 0.3236661 2.677073 ] [ 0.5953025 1.868691 3.011541 ] [ 2.644287 1.363154 4.648241 ] [ 2.19861 3.39541 3.518323 ] [ 4.456442 1.578463 3.034766 ] [ 3.361859 3.152961 1.75355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.274506e-10 3.236661e-11 2.677073e-10 ] [ 5.953025e-11 1.868691e-10 3.011541e-10 ] [ 2.644287e-10 1.363154e-10 4.648241e-10 ] [ 2.19861e-10 3.39541e-10 3.518323e-10 ] [ 4.456442e-10 1.578463e-10 3.034766e-10 ] [ 3.361859e-10 3.152961e-10 1.75355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.327365 -0.757363 -0.7826935 ] [ -0.4183991 -0.1138229 -0.1673189 ] [ 0.592613 0.4385792 0.5416362 ] [ -1.3141576 1.2910888 1.7836467 ] [ -0.4327091 -0.3733868 -0.2125361 ] [ 1.2452878 -0.4850952 -1.1627344 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.2449655378941e-10 -1.213429302056142e-09 -1.254013237283679e-09 ] [ -6.703492617066294e-10 -1.823643907941186e-10 -2.680744320065826e-10 ] [ 9.494707016046417e-10 7.026813463984128e-10 8.677968637685507e-10 ] [ -2.105512600113518e-09 2.068552307779099e-09 2.857717066051208e-09 ] [ -6.932764093391694e-10 -5.982316064040312e-10 -3.405203733014874e-10 ] [ 1.995171015765265e-09 -7.772081947055567e-10 -1.862905887228009e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.797105 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.851410578384457e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1965818 0.110122 2.8998475 ] [ 0.5413373 1.7033687 2.8965188 ] [ 2.9112243 1.684943 4.5209848 ] [ 1.8628086 3.4893638 3.4958247 ] [ 4.2618368 1.2508583 2.6244981 ] [ 3.7572177 3.4436893 2.20582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1965818e-10 1.10122e-11 2.8998475e-10 ] [ 5.413373000000001e-11 1.7033687e-10 2.8965188e-10 ] [ 2.9112243e-10 1.684943e-10 4.5209848e-10 ] [ 1.8628086e-10 3.4893638e-10 3.4958247e-10 ] [ 4.2618368e-10 1.2508583e-10 2.6244981e-10 ] [ 3.7572177e-10 3.4436893e-10 2.20582e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.74e-05 3.92e-05 1.55e-05 ] [ 2.86e-05 -4.66e-05 1.59e-05 ] [ 4.2e-06 7.4e-06 -2.12e-05 ] [ -2.34e-05 2e-06 -2.17e-05 ] [ 2.43e-05 -6.34e-05 -1.43e-05 ] [ 1.37e-05 6.13e-05 2.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.59431724516e-14 6.280532405279998e-14 2.4833737827e-14 ] [ 4.58222517324e-14 -7.466143114439999e-14 2.54746084806e-14 ] [ 6.729141862799999e-15 1.18561070916e-14 -3.39661446408e-14 ] [ -3.749093323559999e-14 3.204353268e-15 -3.476723295779999e-14 ] [ 3.893289220619999e-14 -1.015779985956e-13 -2.29111258662e-14 ] [ 2.19498198858e-14 9.821342766419999e-14 4.133615715719999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.48669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961894275800146e-18 } }