{ "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" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.7019669 -4.9974247 5.2562998 ] [ -15.6759009 4.4061821 -2.1229005 ] [ 34.1837255 -68.6460698 59.5225444 ] [ -11.4975265 61.309016 -52.2218837 ] [ 10.6916688 7.9282964 -10.4340601 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.836167750935545e-08 -8.006757018548454e-09 8.421520651475716e-09 ] [ -2.511556193195768e-08 7.059481947607447e-09 -3.401261549384631e-09 ] [ 5.47683658079448e-08 -1.099831281433649e-07 9.536562904820996e-08 ] [ -1.842106815532845e-08 9.822787207945313e-08 -8.36686811582766e-08 ] [ 1.712994178869679e-08 1.27025311348528e-08 -1.671720715224211e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 14.832823 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.376480223106452e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3830155 1.3028213 2.6979261 ] [ 0.459927 1.7195491 0.2778233 ] [ 3.2887889 -0.4632554 2.3335498 ] [ 2.1426671 1.7030062 2.4670096 ] [ 2.6781052 3.0664994 0.3582843 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.830155e-11 1.3028213e-10 2.6979261e-10 ] [ 4.59927e-11 1.7195491e-10 2.778233e-11 ] [ 3.2887889e-10 -4.632554e-11 2.3335498e-10 ] [ 2.1426671e-10 1.7030062e-10 2.4670096e-10 ] [ 2.6781052e-10 3.0664994e-10 3.582843e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.88e-05 1.99e-05 -8.5e-05 ] [ -2.83e-05 -2.13e-05 8.29e-05 ] [ -1.82e-05 2.23e-05 4.1e-06 ] [ -5.9e-06 -4.58e-05 2.07e-05 ] [ 3.7e-06 2.5e-05 -2.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.818621909504e-14 3.188331475392e-14 -1.36185012768e-13 ] [ -4.534159836864e-14 -3.412636202304e-14 1.3282044186432e-13 ] [ -2.915961449856e-14 3.572853864384e-14 6.568924145279999e-15 ] [ -9.45284206272e-15 -7.337968923264e-14 3.316505605055999e-14 ] [ 5.928053496960001e-15 4.005441552e-14 -3.636940929216e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.168718 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.430296534710814e-18 } }