{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9819486 0.7188158 -8.5885918 ] [ -3.9934009 0.0621761 -0.8903367 ] [ -3.1498315 3.3018716 2.590121 ] [ 0.9060809 -1.3372809 -1.1171564 ] [ 4.0886603 -4.6922943 6.0934721 ] [ 5.0052878 1.4580167 1.6374606 ] [ 0.1251521 0.4886948 0.2750313 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.777608370709012e-09 1.151669878910017e-09 -1.3760441100924e-08 ] [ -6.39813361217457e-09 9.961709461324739e-11 -1.426476657132668e-09 ] [ -5.04658643033717e-09 5.290181525988194e-09 4.149831345432713e-09 ] [ 1.451701646493691e-09 -2.142560211074491e-09 -1.789881880603557e-09 ] [ 6.550755997023429e-09 -7.517884287311386e-09 9.762818618550911e-09 ] [ 8.019355159605265e-09 2.336000288721787e-09 2.62350111241562e-09 ] [ 2.005157703160314e-10 7.829753897173031e-10 4.406487224786441e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.71932 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.198077393836888e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2445891 2.7012671 1.1761981 ] [ 1.2699511 1.6400152 3.221954 ] [ 1.7291158 4.0995216 3.1862857 ] [ 4.5497034 2.2736666 1.3675416 ] [ 3.1389466 0.7374909 4.3288812 ] [ 4.8327152 2.254771 3.7077014 ] [ 3.8036037 4.2976577 4.2772611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2445891e-10 2.7012671e-10 1.1761981e-10 ] [ 1.2699511e-10 1.6400152e-10 3.221954e-10 ] [ 1.7291158e-10 4.0995216e-10 3.1862857e-10 ] [ 4.5497034e-10 2.2736666e-10 1.3675416e-10 ] [ 3.1389466e-10 7.374909e-11 4.3288812e-10 ] [ 4.8327152e-10 2.254771e-10 3.7077014e-10 ] [ 3.8036037e-10 4.2976577e-10 4.2772611e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.65e-05 -6.49e-05 -9.37e-05 ] [ 4.85e-05 -6.96e-05 -8.44e-05 ] [ 7.17e-05 8.74e-05 1.91e-05 ] [ -0.0001245 4.01e-05 -4.78e-05 ] [ 3.66e-05 -3.27e-05 4.48e-05 ] [ -5.83e-05 8.1e-06 0.0001228 ] [ 6.26e-05 3.17e-05 3.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.847944714099999e-14 -1.039812635466e-13 -1.501239506058e-13 ] [ 7.770556674899999e-14 -1.115114937264e-13 -1.352237079096e-13 ] [ 1.148760646578e-13 1.400302378116e-13 3.06015737094e-14 ] [ -1.99470990933e-13 6.42472830234e-14 -7.65840431052e-14 ] [ 5.86396648044e-14 -5.23911759318e-14 7.177751320319999e-14 ] [ -9.34068977622e-14 1.29776307354e-14 1.967472906552e-13 ] [ 1.002962572884e-13 5.078899929779999e-14 6.280532405279998e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.397263 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.947566490815274e-18 } }