{ "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" [ [ 2.180035 1.415878 2.755479 ] [ 0.3300308 2.592052 2.653614 ] [ 2.100058 3.620481 1.423788 ] [ 2.171562 4.236408 3.751897 ] [ 3.719666 3.140383 2.648489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.180035e-10 1.415878e-10 2.755479e-10 ] [ 3.300308e-11 2.592052e-10 2.653614e-10 ] [ 2.100058e-10 3.620481e-10 1.423788e-10 ] [ 2.171562e-10 4.236408e-10 3.751897e-10 ] [ 3.719666e-10 3.140383e-10 2.648489e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3823196 -5.2205463 1.3019455 ] [ -5.2881403 1.3548006 0.6600516 ] [ -4.270291 3.4742362 -8.15473 ] [ -3.5788874 3.2297013 4.816845 ] [ 10.7549992 -2.8381918 1.3758879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.816896766393609e-09 -8.364237229663943e-09 2.085946641655766e-09 ] [ -8.472534756170298e-09 2.170629847165812e-09 1.057519242041633e-09 ] [ -6.841760404212654e-09 5.566340014777033e-09 -1.306531775493639e-08 ] [ -5.734009720755699e-09 5.174551915027367e-09 7.717436445017377e-09 ] [ 1.723140827496271e-08 -4.54728454730627e-09 2.204415426221608e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4956005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.040709925915679e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2874957 1.0654697 2.9173807 ] [ 0.4156574 2.6403903 2.7003047 ] [ 1.9849628 3.9876552 1.1938042 ] [ 1.9897699 4.3488682 3.7729865 ] [ 3.823466 2.9628185 2.6487908 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2874957e-10 1.0654697e-10 2.9173807e-10 ] [ 4.156574e-11 2.6403903e-10 2.7003047e-10 ] [ 1.9849628e-10 3.9876552e-10 1.1938042e-10 ] [ 1.9897699e-10 4.3488682e-10 3.7729865e-10 ] [ 3.823466e-10 2.9628185e-10 2.6487908e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.8e-06 -3.8e-06 -1.1e-06 ] [ -1.01e-05 -4.7e-06 -1.3e-05 ] [ -2.07e-05 5.4e-06 3.7e-06 ] [ 2.18e-05 5.9e-06 -9e-06 ] [ 3.2e-06 -2.7e-06 1.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.292624400640001e-15 -6.08827115904e-15 -1.76239428288e-15 ] [ -1.618198387008e-14 -7.53023011776e-15 -2.08282960704e-14 ] [ -3.316505605055999e-14 8.65175375232e-15 5.928053496960001e-15 ] [ 3.492745033344e-14 9.45284206272e-15 -1.44195895872e-14 ] [ 5.126965186560001e-15 -4.32587687616e-15 3.108222644352e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.977047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758716806882278e-18 } }