{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.4713246 -3.9362659 -7.0449291 ] [ -0.2263261 0.0207407 0.3083118 ] [ -4.4179654 6.2982625 -1.4947026 ] [ 23.9275805 -31.208122 -32.6890632 ] [ -17.63539 -20.2275838 26.6212295 ] [ -5.8110373 23.9879216 -15.0043238 ] [ 18.6344629 25.0650468 29.3034774 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.31856181371494e-08 -6.30659325019098e-09 -1.128722079220665e-08 ] [ -3.626143890843474e-10 3.32302649128038e-11 4.939699619464812e-10 ] [ -7.078360933700463e-09 1.009092901229842e-08 -2.394777580499048e-09 ] [ 3.833621038525403e-08 -5.000092385942134e-08 -5.237365324638927e-08 ] [ -2.825500978947726e-08 -3.240816212663692e-08 4.26519118732515e-08 ] [ -9.310308181362447e-09 3.843288748574389e-08 -2.403957700133009e-08 ] [ 2.985570104551987e-08 4.015863231307646e-08 4.694934678522707e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7300529 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.078273350196394e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2106349 3.5492926 1.3944907 ] [ 0.294205 1.9406254 1.5014713 ] [ 2.6684799 4.5016079 3.7921335 ] [ 4.3935154 2.3399858 2.1931473 ] [ 3.5365413 2.1714919 4.6875186 ] [ 4.5196341 5.0699984 1.8296953 ] [ 5.3935107 4.052651 4.1478173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2106349e-10 3.5492926e-10 1.3944907e-10 ] [ 2.94205e-11 1.9406254e-10 1.5014713e-10 ] [ 2.6684799e-10 4.5016079e-10 3.7921335e-10 ] [ 4.3935154e-10 2.3399858e-10 2.1931473e-10 ] [ 3.5365413e-10 2.1714919e-10 4.6875186e-10 ] [ 4.519634100000001e-10 5.0699984e-10 1.8296953e-10 ] [ 5.3935107e-10 4.052651e-10 4.1478173e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.58e-05 -1.79e-05 -4.64e-05 ] [ 3.48e-05 2.97e-05 8.8e-06 ] [ -1.93e-05 1.38e-05 6.46e-05 ] [ 3e-05 2.2e-06 3.42e-05 ] [ -4.83e-05 -6.25e-05 2.81e-05 ] [ -1.56e-05 3.71e-05 -7.91e-05 ] [ 3.42e-05 -2.4e-06 -1.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.53143908172e-14 -2.86789617486e-14 -7.43409958176e-14 ] [ 5.575574686319999e-14 4.75846460298e-14 1.40991543792e-14 ] [ -3.09220090362e-14 2.21100375492e-14 1.035006105564e-13 ] [ 4.806529901999999e-14 3.5247885948e-15 5.479444088279999e-14 ] [ -7.73851314222e-14 -1.00136039625e-13 4.50211634154e-14 ] [ -2.49939554904e-14 5.94407531214e-14 -1.267321717494e-13 ] [ 5.479444088279999e-14 -3.845223921599999e-15 -1.63422016668e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.779006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.80981677929458e-18 } }