{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3379 -0.2374136 -1.7248232 ] [ 1.5341567 1.2219207 -0.7131107 ] [ -0.4406618 -1.1273539 -0.607408 ] [ -0.5579995 -0.177914 0.7479689 ] [ 0.5945375 0.198934 1.2791302 ] [ -0.4931472 -0.0978133 1.2825673 ] [ -0.2989857 0.2196401 -0.2643244 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.4137548016832e-10 -3.803785193799628e-10 -2.763471406053442e-09 ] [ 2.457989997383679e-09 1.957732778011571e-09 -1.142529291582323e-09 ] [ -7.060180336396455e-10 -1.806220061947701e-09 -9.731748968868863e-10 ] [ -8.940137533180896e-10 -2.850496513130112e-10 1.198378284665493e-09 ] [ 9.525540826888802e-10 3.187274038822272e-10 2.049392501399228e-09 ] [ -7.901089144529818e-10 -1.567141824632967e-10 2.05489934266258e-09 ] [ -4.790278984935226e-10 3.519022332101741e-10 -4.234943739869876e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -19.451941 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.116544509938098e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5765343 1.5667324 2.1525861 ] [ 3.1053459 4.7652556 4.2267993 ] [ 1.519893 3.5622076 2.916846 ] [ 4.2805007 2.8295971 1.1147782 ] [ 3.2294949 2.3867964 4.2935331 ] [ 3.268864 4.8584224 1.8516157 ] [ 4.9784824 3.6829786 3.2283247 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5765343e-10 1.5667324e-10 2.1525861e-10 ] [ 3.1053459e-10 4.7652556e-10 4.2267993e-10 ] [ 1.519893e-10 3.5622076e-10 2.916846e-10 ] [ 4.2805007e-10 2.8295971e-10 1.1147782e-10 ] [ 3.2294949e-10 2.3867964e-10 4.2935331e-10 ] [ 3.268864e-10 4.8584224e-10 1.8516157e-10 ] [ 4.9784824e-10 3.6829786e-10 3.2283247e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.18e-05 -1.25e-05 -7.4e-06 ] [ -1.93e-05 -1.02e-05 -1.27e-05 ] [ 3.77e-05 5.07e-05 -9.3e-06 ] [ 1.93e-05 -2.39e-05 1.43e-05 ] [ 6e-06 -1.25e-05 -1.8e-06 ] [ -1.81e-05 -2.44e-05 5.54e-05 ] [ -1.38e-05 3.27e-05 -3.86e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.890568412544e-14 -2.002720776e-14 -1.185610699392e-14 ] [ -3.092200878144e-14 -1.634220153216e-14 -2.034764308416e-14 ] [ 6.040205860416e-14 8.123035467456e-14 -1.490024257344e-14 ] [ 3.092200878144e-14 -3.829202123712e-14 2.291112567744e-14 ] [ 9.6130597248e-15 -2.002720776e-14 -2.88391791744e-15 ] [ -2.899939683648e-14 -3.909310954752e-14 8.876058479231999e-14 ] [ -2.211003736704e-14 5.239117550016001e-14 -6.184401756288e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864800740979e-18 } }