{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5191789 -0.4469639 0.2988437 ] [ -1.7660296 -0.5421401 1.6006113 ] [ 0.179078 1.7444425 -1.1167581 ] [ 0.437726 0.0959662 -1.0436715 ] [ -0.3699533 -0.8513048 0.2609746 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.433992916392661e-09 -7.161151109215893e-10 4.788003894133689e-10 ] [ -2.829491336760776e-09 -8.686041934181742e-10 2.564462003848295e-09 ] [ 2.869145848996224e-10 2.794904989829904e-09 -1.789243718909029e-09 ] [ 7.013143635163009e-10 1.53754802027017e-10 -1.672146077095267e-09 ] [ -5.927305280478086e-10 -1.36394064773482e-09 4.181274027426317e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.38208239923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.020869970473408e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.2203862 0.7192768 2.3820327 ] [ 1.3509474 2.0328092 3.0179797 ] [ 1.6009998 4.0657304 1.8884886 ] [ 3.2598442 1.8425117 4.412434 ] [ 3.6439024 3.0526199 2.4092509 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2203862e-10 7.192768000000001e-11 2.3820327e-10 ] [ 1.3509474e-10 2.0328092e-10 3.0179797e-10 ] [ 1.6009998e-10 4.0657304e-10 1.8884886e-10 ] [ 3.2598442e-10 1.8425117e-10 4.412434e-10 ] [ 3.6439024e-10 3.0526199e-10 2.4092509e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-07 -1.28e-05 -1.54e-05 ] [ 9.4e-06 2.02e-05 -5.4e-06 ] [ 5.8e-06 -2.39e-05 1.36e-05 ] [ -5.8e-06 1.49e-05 1e-07 ] [ -9.9e-06 1.6e-06 7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-16 -2.050786074624e-14 -2.467351996032e-14 ] [ 1.506046023552e-14 3.236396774016e-14 -8.65175375232e-15 ] [ 9.292624400640001e-15 -3.829202123712e-14 2.178960204288e-14 ] [ -9.292624400640001e-15 2.387243164992e-14 1.6021766208e-16 ] [ -1.586154854592e-14 2.56348259328e-15 1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.057896399234949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.103643361282738e-19 } }