{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6381083 1.2397535 -2.0917932 ] [ -3.9624099 -1.136899 4.5366924 ] [ -3.5897841 -3.4269106 -0.4374678 ] [ 1.4612962 -0.9181194 -4.7165619 ] [ 8.501043 -7.3411644 -1.0856638 ] [ 0.3270519 8.9292563 6.3393408 ] [ 1.9009112 2.6540836 -2.5445467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.431068682998433e-09 1.986304073254973e-09 -3.351422160588419e-09 ] [ -6.348480503806466e-09 -1.821512998010899e-09 7.268582499041042e-09 ] [ -5.75146815873957e-09 -5.4905160448917e-09 -7.009006815128103e-10 ] [ 2.341254607703881e-09 -1.470989437782923e-09 -7.556765206736029e-09 ] [ 1.362017234701549e-08 -1.176184197112926e-08 -1.739425158408887e-09 ] [ 5.239949079682195e-10 1.430624568499111e-08 1.015674362104357e-08 ] [ 3.045595482856873e-09 4.252310693568699e-09 -4.076813233273792e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.374824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.142883032011474e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.878227 2.5884331 2.8707839 ] [ 2.4871174 0.8969938 5.749708 ] [ 2.0129728 0.068857 3.3742185 ] [ 3.7390235 1.1678443 1.6651957 ] [ 4.4798196 0.6643546 4.0771627 ] [ 3.5907138 2.9959272 4.7704467 ] [ 4.239233 3.5809924 2.3580774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.878227e-10 2.5884331e-10 2.8707839e-10 ] [ 2.4871174e-10 8.969938e-11 5.749708e-10 ] [ 2.0129728e-10 6.8857e-12 3.3742185e-10 ] [ 3.7390235e-10 1.1678443e-10 1.6651957e-10 ] [ 4.4798196e-10 6.643546000000001e-11 4.0771627e-10 ] [ 3.5907138e-10 2.9959272e-10 4.770446700000001e-10 ] [ 4.239233e-10 3.5809924e-10 2.3580774e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -2.2e-06 1.4e-06 ] [ -4e-07 -1.4e-06 0.0 ] [ 1.5e-06 1e-07 -3e-07 ] [ 3e-07 4.1e-06 -1.9e-06 ] [ -4.7e-06 -2.4e-06 4.8e-06 ] [ 3.5e-06 2.3e-06 -4.2e-06 ] [ -3.5e-06 -4e-07 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 -3.52478856576e-15 2.24304726912e-15 ] [ -6.408706483200001e-16 -2.24304726912e-15 0.0 ] [ 2.4032649312e-15 1.6021766208e-16 -4.8065298624e-16 ] [ 4.8065298624e-16 6.568924145279999e-15 -3.04413557952e-15 ] [ -7.53023011776e-15 -3.84522388992e-15 7.69044777984e-15 ] [ 5.6076181728e-15 3.68500622784e-15 -6.72914180736e-15 ] [ -5.6076181728e-15 -6.408706483200001e-16 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -16.961949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.717603813100194e-18 } }