{ "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" [ [ -14.5173225 -20.5122469 -10.6156976 ] [ -34.4339187 3.855736 29.6396912 ] [ 9.4780979 12.7038442 -43.8724261 ] [ 28.902558 -22.5575854 17.1851637 ] [ 10.5705854 26.5102521 7.6632688 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.325931470611381e-08 -3.286424242325727e-08 -1.700822250820267e-08 ] [ -5.516921950366794e-08 6.177570075176909e-09 4.74880202883715e-08 ] [ 1.518558686503358e-08 2.035380217152568e-08 -7.029137539519572e-08 ] [ 4.6307002708916e-08 -3.614123594957942e-08 2.753366750476082e-08 ] [ 1.693594479604982e-08 4.247410612613411e-08 1.227791011026607e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.991396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.644933687555464e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7197135 0.7197896 0.9315554 ] [ 1.8410403 2.5364769 2.5606054 ] [ 3.6036365 2.7885866 -0.3587851 ] [ 4.9088521 1.0518683 2.2819365 ] [ 4.1826596 3.5314838 2.0576284 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7197135e-10 7.197896e-11 9.315554e-11 ] [ 1.8410403e-10 2.5364769e-10 2.5606054e-10 ] [ 3.6036365e-10 2.7885866e-10 -3.587851e-11 ] [ 4.9088521e-10 1.0518683e-10 2.2819365e-10 ] [ 4.1826596e-10 3.5314838e-10 2.0576284e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.93e-05 2.41e-05 -1.49e-05 ] [ 1.14e-05 -1.23e-05 -1.5e-06 ] [ 7.3e-06 -1.11e-05 1.63e-05 ] [ 2.96e-05 -1.09e-05 1.63e-05 ] [ -1.91e-05 1.02e-05 -1.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.694377498944e-14 3.861245656128e-14 -2.387243164992e-14 ] [ 1.826481347712e-14 -1.970677243584e-14 -2.4032649312e-15 ] [ 1.169588933184e-14 -1.778416049088e-14 2.611547891904e-14 ] [ 4.742442797568e-14 -1.746372516672e-14 2.611547891904e-14 ] [ -3.060157345728e-14 1.634220153216e-14 -2.595526125696e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.5001568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.522092911889414e-18 } }