{ "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" [ [ -2.313067213035701e-09 -2.387405164717697e-09 -6.800160585149337e-09 ] [ -3.281725582009128e-10 -8.838409003637634e-10 4.635429614031219e-09 ] [ -4.669184912226984e-09 7.67464333201157e-09 -2.557644763398694e-09 ] [ 3.497841746210417e-09 1.598199070288431e-09 5.246897762914703e-10 ] [ 1.500496096099824e-09 -3.33255143136951e-09 9.808163261428714e-10 ] [ -6.914161220494318e-10 -3.063962860881077e-09 2.338175884373096e-09 ] [ 3.003502963202789e-09 3.949181152497089e-10 8.786940681447018e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -26.879732 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.306607853858208e-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" [ [ 2.62756967976e-14 -2.70767851146e-14 -4.26178984644e-14 ] [ -3.8452239216e-14 1.15356717648e-14 4.22974631376e-14 ] [ -9.452842140600001e-15 -1.4419589706e-15 1.95465549348e-14 ] [ 9.2926244772e-15 8.010883169999999e-15 -1.10550187746e-14 ] [ -1.39389367158e-14 3.5247885948e-15 -1.61819840034e-14 ] [ -2.403264951e-15 -1.15356717648e-14 1.21765424184e-14 ] [ 2.86789617486e-14 1.69830723204e-14 -4.3258769118e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.311464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.856431936313217e-18 } }