{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.443703 -1.4901011 -4.2443264 ] [ -0.2048292 -0.5516501 2.8932076 ] [ -2.914276 4.7901356 -1.5963563 ] [ 2.1831811 0.9975174 0.3274856 ] [ 0.936536 -2.080015 0.6121774 ] [ -0.431548 -1.9123752 1.4593746 ] [ 1.8746391 0.2464885 0.5484377 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.313067193978822e-09 -2.387405145048363e-09 -6.80016052912423e-09 ] [ -3.281725554971674e-10 -8.838408930819822e-10 4.635429575840879e-09 ] [ -4.669184873758541e-09 7.674643268781782e-09 -2.557644742326791e-09 ] [ 3.497841717392427e-09 1.598199057121202e-09 5.246897719686605e-10 ] [ 1.500496083737549e-09 -3.332551403913312e-09 9.8081631806213e-10 ] [ -6.914161163529984e-10 -3.063962835637725e-09 2.338175865109352e-09 ] [ 3.003502938457553e-09 3.949181119960608e-10 8.786940609053242e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.879732 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.306607818376963e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7208833 2.5857239 1.7850077 ] [ 1.9624356 2.7665799 4.6609975 ] [ 2.0868355 4.4550944 3.0732473 ] [ 5.0652792 2.2780636 1.8129278 ] [ 3.7825918 1.6728042 3.6749663 ] [ 4.213313 4.417571 2.0898896 ] [ 4.0020306 3.912127 4.3861117 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7208833e-10 2.5857239e-10 1.7850077e-10 ] [ 1.9624356e-10 2.7665799e-10 4.6609975e-10 ] [ 2.0868355e-10 4.4550944e-10 3.0732473e-10 ] [ 5.0652792e-10 2.2780636e-10 1.8129278e-10 ] [ 3.7825918e-10 1.6728042e-10 3.6749663e-10 ] [ 4.213313e-10 4.417571e-10 2.0898896e-10 ] [ 4.002030600000001e-10 3.912127e-10 4.3861117e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.64e-05 -1.69e-05 -2.66e-05 ] [ -2.4e-05 7.2e-06 2.64e-05 ] [ -5.9e-06 -9e-07 1.22e-05 ] [ 5.8e-06 5e-06 -6.9e-06 ] [ -8.7e-06 2.2e-06 -1.01e-05 ] [ -1.5e-06 -7.2e-06 7.6e-06 ] [ 1.79e-05 1.06e-05 -2.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.627569658112e-14 -2.707678489152e-14 -4.261789811328e-14 ] [ -3.84522388992e-14 1.153567166976e-14 4.229746278912e-14 ] [ -9.45284206272e-15 -1.44195895872e-15 1.954655477376e-14 ] [ 9.292624400640001e-15 8.010883104e-15 -1.105501868352e-14 ] [ -1.393893660096e-14 3.52478856576e-15 -1.618198387008e-14 ] [ -2.4032649312e-15 -1.153567166976e-14 1.217654231808e-14 ] [ 2.867896151232001e-14 1.698307218048e-14 -4.32587687616e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.311464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.856431896302086e-18 } }