{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.8328 1.144076 3.909989 ] [ 1.831555 2.949109 3.983595 ] [ 4.980623 2.123246 2.998848 ] [ 3.28235 2.585733 1.880535 ] [ 4.448764 2.855471 5.04642 ] [ 4.331941 4.016039 3.033368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8328e-10 1.144076e-10 3.909989e-10 ] [ 1.831555e-10 2.949109e-10 3.983595000000001e-10 ] [ 4.980622999999999e-10 2.123246e-10 2.998848e-10 ] [ 3.28235e-10 2.585733e-10 1.880535e-10 ] [ 4.448764e-10 2.855471e-10 5.04642e-10 ] [ 4.331941e-10 4.016039e-10 3.033368e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 40.9214146 -71.6045078 -1.1527284 ] [ -39.4637334 69.7258334 0.9432319 ] [ 82.3711919 -115.9217009 21.4641539 ] [ -75.2994298 -19.2023827 -61.2634881 ] [ -0.7357688 -6.3199007 27.9180041 ] [ -7.7936744 143.3226586 12.0908267 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.556333430234645e-08 -1.147230692862307e-07 -1.846874507828206e-09 ] [ -6.322787154388537e-08 1.117131010596568e-07 1.511224110623425e-09 ] [ 1.319731989769101e-07 -1.857270405555168e-07 3.438936584715997e-08 ] [ -1.206429869790833e-07 -3.076560887906583e-08 -9.815492915115704e-08 ] [ -1.178831579386219e-09 -1.012559723074024e-08 4.47295738369362e-08 ] [ -1.248684301668397e-08 2.296282147316792e-07 1.937164002448333e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 31.269629 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.009946893764878e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9770847 0.8366957 3.8879832 ] [ 1.913835 3.3511337 4.0079486 ] [ 5.3221749 1.8734243 2.9429675 ] [ 2.9709528 2.425075 1.6644054 ] [ 4.265061 2.7994858 5.2865164 ] [ 4.2589245 4.3878595 3.0629339 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9770847e-10 8.366957e-11 3.8879832e-10 ] [ 1.913835e-10 3.3511337e-10 4.0079486e-10 ] [ 5.3221749e-10 1.8734243e-10 2.9429675e-10 ] [ 2.9709528e-10 2.425075e-10 1.6644054e-10 ] [ 4.265061000000001e-10 2.7994858e-10 5.2865164e-10 ] [ 4.2589245e-10 4.3878595e-10 3.0629339e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.01e-05 7.1e-06 2.07e-05 ] [ -2.9e-06 6.4e-06 2.81e-05 ] [ 1.43e-05 -2.63e-05 1.31e-05 ] [ -1.8e-05 -1.36e-05 -5.25e-05 ] [ -2.18e-05 -1.91e-05 -1.54e-05 ] [ 8.2e-06 4.55e-05 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.22037503434e-14 1.13754541014e-14 3.316505632379999e-14 ] [ -4.6463122386e-15 1.02539304576e-14 4.50211634154e-14 ] [ 2.29111258662e-14 -4.21372454742e-14 2.09885139054e-14 ] [ -2.8839179412e-14 -2.17896022224e-14 -8.4114273285e-14 ] [ -3.492745062119999e-14 -3.06015737094e-14 -2.46735201636e-14 ] [ 1.31378483988e-14 7.289903684699999e-14 9.452842140600001e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.048264 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.372303676706337e-18 } }