{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.024908 1.18877 2.927879 ] [ 1.938594 2.418534 4.826435 ] [ 2.412467 3.694527 2.059811 ] [ 3.090256 4.25078 4.272664 ] [ 3.913894 1.726388 1.808826 ] [ 4.03064 2.069757 3.989682 ] [ 4.599294 3.851686 2.39416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.024908e-10 1.18877e-10 2.927879e-10 ] [ 1.938594e-10 2.418534e-10 4.826435e-10 ] [ 2.412467e-10 3.694527e-10 2.059811e-10 ] [ 3.090256e-10 4.25078e-10 4.272664e-10 ] [ 3.913894e-10 1.726388e-10 1.808826e-10 ] [ 4.03064e-10 2.069757e-10 3.989682e-10 ] [ 4.599294e-10 3.851686e-10 2.39416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.5154162 -5.2890887 -3.4400614 ] [ -9.796587 -1.8527666 8.8098319 ] [ -13.9076045 3.1044606 -7.9783571 ] [ 1.3305164 10.1570178 2.812179 ] [ 3.956842 -6.1832007 -13.950392 ] [ 15.0301059 -6.2831865 13.6103771 ] [ 11.9021435 6.346764 0.1364227 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.364320075202158e-08 -8.474054260477465e-09 -5.511585949196517e-09 ] [ -1.569586265503321e-08 -2.968459330319106e-09 1.411490670335804e-08 ] [ -2.228243878123287e-08 4.973894193514741e-09 -1.278273721801369e-08 ] [ 2.131722269670981e-09 1.627333645620945e-08 4.505607447304724e-09 ] [ 6.339559744599513e-09 -9.906579603254195e-09 -2.235099191339535e-08 ] [ 2.408088428112815e-08 -1.006677451442618e-08 2.18062279898917e-08 ] [ 1.906933605310668e-08 1.016863689853509e-08 2.185732604864122e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.09005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937039545430304e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5385211 1.5330467 2.7787654 ] [ 2.3577502 2.2454728 4.9952348 ] [ 2.2942465 3.6912594 1.685871 ] [ 2.6078075 4.5164347 4.0616276 ] [ 3.8703962 1.565753 1.7864436 ] [ 4.6427738 1.7720891 4.1914958 ] [ 4.6985576 3.8763863 2.7800188 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5385211e-10 1.5330467e-10 2.7787654e-10 ] [ 2.3577502e-10 2.2454728e-10 4.9952348e-10 ] [ 2.2942465e-10 3.6912594e-10 1.685871e-10 ] [ 2.6078075e-10 4.5164347e-10 4.0616276e-10 ] [ 3.8703962e-10 1.565753e-10 1.7864436e-10 ] [ 4.6427738e-10 1.7720891e-10 4.1914958e-10 ] [ 4.6985576e-10 3.8763863e-10 2.7800188e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.59e-05 9.3e-06 2.8e-06 ] [ 1.01e-05 -1.41e-05 3.1e-06 ] [ -1.95e-05 5.69e-05 -1.3e-06 ] [ -2.41e-05 -1.3e-05 -6.47e-05 ] [ -1.8e-05 -5.11e-05 -2.18e-05 ] [ 7.64e-05 -1.08e-05 3.44e-05 ] [ 1.11e-05 2.28e-05 4.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.751814068672e-14 1.490024257344e-14 4.48609453824e-15 ] [ 1.618198387008e-14 -2.259069035328e-14 4.96674752448e-15 ] [ -3.12424441056e-14 9.116384972352e-14 -2.08282960704e-15 ] [ -3.861245656128e-14 -2.08282960704e-14 -1.0366082736576e-13 ] [ -2.88391791744e-14 -8.187122532288001e-14 -3.492745033344e-14 ] [ 1.2240629382912e-13 -1.730350750464e-14 5.511487575552001e-14 ] [ 1.778416049088e-14 3.652962695424e-14 7.610338948800001e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }