{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.5044792 -3.2961741 -3.6724996 ] [ 0.1780801 -1.1934053 -0.6789958 ] [ -3.3622435 -1.1723291 6.4742622 ] [ 0.4394938 0.3285617 0.8994539 ] [ 2.7923412 -2.2950206 -0.4143799 ] [ 2.5951039 2.4498797 -2.7715163 ] [ 3.8617036 5.1784875 0.1636756 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.042132450471989e-08 -5.281053081106481e-09 -5.883992999017352e-09 ] [ 2.853157728497261e-10 -1.91204607079881e-09 -1.087871196381393e-09 ] [ -5.386907929136765e-09 -1.878278275903506e-09 1.037291153376917e-08 ] [ 7.04146691346551e-10 5.264138742303034e-10 1.441084010067381e-09 ] [ 4.473823787936617e-09 -3.677028349574389e-09 -6.63909787909442e-10 ] [ 4.157814797126901e-09 3.925139979112518e-09 -4.440458620026119e-09 ] [ 6.187131224379195e-09 8.29685160360504e-09 2.622372197154125e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.937328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.752353121562123e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.488284 3.2587364 1.6047937 ] [ 2.6064028 0.6676633 2.8022057 ] [ 2.3828383 2.7364534 4.0245542 ] [ 4.6600237 1.2750181 1.750097 ] [ 5.4071856 2.09396 4.0022175 ] [ 3.9504027 3.5347582 1.0716438 ] [ 4.3056568 4.2724224 3.379647 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.488284e-10 3.2587364e-10 1.6047937e-10 ] [ 2.6064028e-10 6.676633e-11 2.8022057e-10 ] [ 2.3828383e-10 2.7364534e-10 4.0245542e-10 ] [ 4.660023700000001e-10 1.2750181e-10 1.750097e-10 ] [ 5.407185600000001e-10 2.09396e-10 4.002217500000001e-10 ] [ 3.9504027e-10 3.5347582e-10 1.0716438e-10 ] [ 4.3056568e-10 4.2724224e-10 3.379647e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.92e-05 -1.27e-05 2.21e-05 ] [ 2e-07 6.1e-06 -2.09e-05 ] [ 1.38e-05 4.3e-06 1.49e-05 ] [ 9.4e-06 -1.66e-05 -1.43e-05 ] [ -4.82e-05 2.12e-05 9.9e-06 ] [ -2.92e-05 -5e-06 -3.04e-05 ] [ 1.48e-05 2.8e-06 1.87e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.280532353535999e-14 -2.034764308416e-14 3.540810331968e-14 ] [ 3.2043532416e-16 9.77327738688e-15 -3.348549137472e-14 ] [ 2.211003736704e-14 6.889359469440001e-15 2.387243164992e-14 ] [ 1.506046023552e-14 -2.659613190528e-14 -2.291112567744e-14 ] [ -7.722491312256001e-14 3.396614436096001e-14 1.586154854592e-14 ] [ -4.678355732736e-14 -8.010883104e-15 -4.870616927232e-14 ] [ 2.371221398784e-14 4.48609453824e-15 2.996070280896e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.508478 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.965385073819114e-18 } }