{ "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" [ [ -1.3932597 0.1600233 -0.7680131 ] [ 1.1607476 0.1830428 0.3079668 ] [ 0.2880362 0.1112994 -0.9364526 ] [ 1.285935 -1.988546 -1.8334856 ] [ -0.8193995 -0.4753486 1.6689088 ] [ -1.2336258 0.8741755 -0.0180603 ] [ 0.7115661 1.1353536 1.579136 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.232248136433849e-09 2.563855921555722e-10 -1.230492643425905e-09 ] [ 1.859722682691578e-09 2.932668971819352e-10 4.934172110077512e-10 ] [ 4.614848693861507e-10 1.783212980582196e-10 -1.500362474568548e-09 ] [ 2.06029500984279e-09 -3.186001936834164e-09 -2.93756778709547e-09 ] [ -1.312822732811283e-09 -7.615924199246123e-10 2.673886683636979e-09 ] [ -1.976486431859557e-09 1.400583560115267e-09 -2.89357906630302e-11 ] [ 1.140054578966507e-09 1.819037009247782e-09 2.530054801108224e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.867931005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.542322828736167e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1764905 3.1619922 1.0151625 ] [ 1.4914635 2.5598393 2.4531516 ] [ 1.9417054 4.5267159 3.7242868 ] [ 4.5920346 1.9268307 2.3343764 ] [ 3.1640375 2.5073522 4.1789561 ] [ 3.6085031 5.0492147 2.2348283 ] [ 5.0422867 3.8937079 3.6055124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1764905e-10 3.1619922e-10 1.0151625e-10 ] [ 1.4914635e-10 2.5598393e-10 2.4531516e-10 ] [ 1.9417054e-10 4.526715900000001e-10 3.7242868e-10 ] [ 4.5920346e-10 1.9268307e-10 2.3343764e-10 ] [ 3.1640375e-10 2.5073522e-10 4.1789561e-10 ] [ 3.6085031e-10 5.049214700000001e-10 2.2348283e-10 ] [ 5.0422867e-10 3.8937079e-10 3.6055124e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 -3.8e-06 1.31e-05 ] [ 1.23e-05 4.9e-06 -1e-06 ] [ 2.68e-05 -5.2e-06 1.1e-06 ] [ -3e-07 2.05e-05 7.4e-06 ] [ -1.51e-05 -2.2e-05 3.6e-06 ] [ 1.9e-06 7.5e-06 -1.59e-05 ] [ -2.17e-05 -1.9e-06 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.248488872599999e-15 -6.088271209199999e-15 2.09885139054e-14 ] [ 1.97067725982e-14 7.850665506599998e-15 -1.602176634e-15 ] [ 4.293833379119999e-14 -8.331318496799998e-15 1.7623942974e-15 ] [ -4.806529901999999e-16 3.2844620997e-14 1.18561070916e-14 ] [ -2.41928671734e-14 -3.5247885948e-14 5.767835882399999e-15 ] [ 3.0441356046e-15 1.2016324755e-14 -2.54746084806e-14 ] [ -3.476723295779999e-14 -3.0441356046e-15 -1.32980660622e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.808943005765546 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333960226207528e-18 } }