{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.697876 3.711698 1.143091 ] [ 3.423522 2.241155 2.183353 ] [ 3.951754 3.941629 0.5726112 ] [ 3.96365 5.193256 2.218192 ] [ 5.084028 3.36384 3.521791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.697876e-10 3.711698e-10 1.143091e-10 ] [ 3.423522e-10 2.241155e-10 2.183353e-10 ] [ 3.951754000000001e-10 3.941629e-10 5.726112e-11 ] [ 3.96365e-10 5.193256e-10 2.218192e-10 ] [ 5.084028e-10 3.36384e-10 3.521791e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6226048 -0.0977275 0.1254806 ] [ 0.4894075 -0.6323515 0.6894259 ] [ 0.4615037 -1.0723989 -2.4079031 ] [ 0.9741466 1.1714354 2.6435001 ] [ -1.3024531 0.6310425 -1.0505035 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.975228545578598e-10 -1.56576715709232e-10 2.010420836839565e-10 ] [ 7.84117254544176e-10 -1.013138789427811e-09 1.104582058753999e-09 ] [ 7.39410438552697e-10 -1.718172445751637e-09 -3.857886051971845e-09 ] [ 1.560754907751809e-09 1.876846410657497e-09 4.235354057302462e-09 ] [ -2.086759906508484e-09 1.011041540231184e-09 -1.683092147768573e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6456882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.224974288396644e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8714044 3.8534441 2.0180753 ] [ 3.473449 2.145205 1.7935491 ] [ 4.4352026 3.7470997 0.3638608 ] [ 3.774885 5.2354269 2.0620662 ] [ 4.5658891 3.4704022 3.4014868 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8714044e-10 3.8534441e-10 2.0180753e-10 ] [ 3.473449e-10 2.145205e-10 1.7935491e-10 ] [ 4.435202600000001e-10 3.7470997e-10 3.638608e-11 ] [ 3.774885e-10 5.2354269e-10 2.0620662e-10 ] [ 4.5658891e-10 3.4704022e-10 3.4014868e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.93e-05 6.2e-06 -3e-07 ] [ 5.6e-06 3.34e-05 -4e-06 ] [ -8.1e-06 -6.1e-06 1.91e-05 ] [ -8.5e-06 -4.42e-05 2.8e-06 ] [ -8.2e-06 1.07e-05 -1.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.092200878144e-14 9.93349504896e-15 -4.8065298624e-16 ] [ 8.972189076479999e-15 5.351269913472e-14 -6.4087064832e-15 ] [ -1.297763062848e-14 -9.77327738688e-15 3.060157345728e-14 ] [ -1.36185012768e-14 -7.081620663936001e-14 4.48609453824e-15 ] [ -1.313784829056e-14 1.714328984256e-14 -2.819830852608e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }