{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3689926 -21.8995391 -14.1550261 ] [ -25.4880086 5.6382901 17.8774973 ] [ -4.9946125 4.2435359 -45.3865565 ] [ 29.0941872 -26.4165847 22.5072426 ] [ 15.7574265 38.4342977 19.1568427 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.302166419783891e-08 -3.508692984138938e-08 -2.267885207108015e-08 ] [ -4.083629182611105e-08 9.033536653933522e-09 2.864290844845809e-08 ] [ -8.002251443384323e-09 6.79889406452016e-09 -7.271728032202082e-08 ] [ 4.661402691706188e-08 -4.23240347564219e-08 3.60605781894894e-08 ] [ 2.52461805502724e-08 6.157853371913994e-08 3.069264575515347e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.5252775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.205682377486593e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3335966 0.8116705 0.7283902 ] [ 2.2087554 2.2287084 2.9117538 ] [ 4.0909279 2.4700325 -0.2474565 ] [ 4.6565711 1.2306951 2.1443646 ] [ 3.966051 3.8870989 1.9358884 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3335966e-10 8.116704999999999e-11 7.283902000000001e-11 ] [ 2.2087554e-10 2.2287084e-10 2.9117538e-10 ] [ 4.0909279e-10 2.4700325e-10 -2.474565e-11 ] [ 4.6565711e-10 1.2306951e-10 2.1443646e-10 ] [ 3.966051e-10 3.8870989e-10 1.9358884e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.4e-06 -7.3e-06 6.7e-06 ] [ -4e-07 2.9e-06 -7.6e-06 ] [ -4.2e-06 9.6e-06 8e-06 ] [ -6.9e-06 1e-07 -3.9e-06 ] [ 6e-06 -5.2e-06 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.6517538236e-15 -1.16958894282e-14 1.07345834478e-14 ] [ -6.408706536e-16 4.6463122386e-15 -1.21765424184e-14 ] [ -6.729141862799999e-15 1.53808956864e-14 1.2817413072e-14 ] [ -1.10550187746e-14 1.602176634e-16 -6.248488872599999e-15 ] [ 9.613059803999999e-15 -8.331318496799998e-15 -5.2871828922e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.98496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.561072940742464e-18 } }