{ "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" [ [ 0.1566283 0.5933374 0.8739195 ] [ 1.297564 0.9258578 2.544594 ] [ 0.4571517 2.983075 2.098516 ] [ 2.386894 1.49419 0.7409216 ] [ 2.718839 0.4423949 1.931638 ] [ 1.685227 2.953094 0.1464224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.566283e-11 5.933374e-11 8.739195e-11 ] [ 1.297564e-10 9.258578e-11 2.544594e-10 ] [ 4.571517e-11 2.983075e-10 2.098516e-10 ] [ 2.386894e-10 1.49419e-10 7.409215999999999e-11 ] [ 2.718839e-10 4.423949e-11 1.931638e-10 ] [ 1.685227e-10 2.953094e-10 1.464224e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7274526 -0.3057213 -2.2579834 ] [ -1.4961923 -0.3412097 5.3673579 ] [ -0.2886058 0.6499436 -0.2239345 ] [ 2.2312319 -0.5391254 -3.2885287 ] [ 2.5530129 -1.922659 1.1005435 ] [ -1.271994 2.4587718 -0.6974547 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.767684192062548e-09 -4.898195233761041e-10 -3.617688243439875e-09 ] [ -2.397164343030718e-09 -5.466782086341498e-10 8.599455413695308e-09 ] [ -4.623974691968772e-10 1.041324449337842e-09 -3.58782623446473e-10 ] [ 3.574827615215424e-09 -8.637741186759035e-10 -5.268803843378395e-09 ] [ 4.090377614680578e-09 -3.080439324949805e-09 1.763265080400579e-09 ] [ -2.037959065388196e-09 3.939386726298121e-09 -1.11744562361348e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.041107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929198028289384e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3072565 0.8217995 0.830828 ] [ 1.0108073 0.9093866 3.0906108 ] [ 0.2401779 2.8782103 2.0079277 ] [ 2.4679 1.1396876 0.0329266 ] [ 3.0079819 0.3569328 2.1187355 ] [ 1.6681803 3.2859324 0.2549829 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.072565e-11 8.217995e-11 8.30828e-11 ] [ 1.0108073e-10 9.093866000000001e-11 3.0906108e-10 ] [ 2.401779e-11 2.8782103e-10 2.0079277e-10 ] [ 2.4679e-10 1.1396876e-10 3.29266e-12 ] [ 3.0079819e-10 3.569328e-11 2.1187355e-10 ] [ 1.6681803e-10 3.2859324e-10 2.549829e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.32e-05 3.47e-05 3.29e-05 ] [ -6.3e-06 -3.9e-06 1.1e-06 ] [ -3.83e-05 6.6e-06 -2.78e-05 ] [ -1.76e-05 1.35e-05 3.29e-05 ] [ 2.45e-05 -4.96e-05 -2.32e-05 ] [ -5.5e-06 -1.3e-06 -1.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.92140305888e-14 5.55955291998e-14 5.271161125859999e-14 ] [ -1.00937127942e-14 -6.248488872599999e-15 1.7623942974e-15 ] [ -6.13633650822e-14 1.05743657844e-14 -4.454051042519999e-14 ] [ -2.81983087584e-14 2.162938455899999e-14 5.271161125859999e-14 ] [ 3.925332753299999e-14 -7.94679610464e-14 -3.71704979088e-14 ] [ -8.811971486999999e-15 -2.0828296242e-15 -2.53143908172e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.48669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961894275800146e-18 } }