{ "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" [ [ 1.713643 2.381995 2.341744 ] [ 1.446412 4.331189 1.115178 ] [ 2.556484 4.191275 3.378185 ] [ 3.693858 2.577115 3.453442 ] [ 3.860603 3.859948 1.679861 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.713643e-10 2.381995e-10 2.341744e-10 ] [ 1.446412e-10 4.331189e-10 1.115178e-10 ] [ 2.556484e-10 4.191275e-10 3.378185e-10 ] [ 3.693858e-10 2.577115e-10 3.453442e-10 ] [ 3.860603e-10 3.859948e-10 1.679861e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5674782 -4.4767073 -1.1692059 ] [ -0.1184831 0.5876082 -0.4932794 ] [ -7.2684973 11.3549512 4.3149871 ] [ 7.195251 -10.0250309 3.6761891 ] [ 4.7592077 2.5591788 -6.328691 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.317906788053666e-09 -7.172475774224692e-09 -1.873274357881423e-09 ] [ -1.898308527799085e-10 9.414521202303707e-10 -7.903207222022516e-10 ] [ -1.164541644240792e-08 1.819263734296491e-08 6.913371450673592e-09 ] [ 1.152806293298782e-08 -1.606187013077759e-08 5.889904229659794e-09 ] [ 7.62509131047134e-09 4.100256441807e-09 -1.013968076046737e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8540365 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.578790690080986e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4051028 2.2817985 2.609917 ] [ 1.7137167 4.1079967 1.0817813 ] [ 2.3666334 4.4110523 3.4622383 ] [ 3.7384672 2.3572385 3.1713044 ] [ 4.0470799 4.183436 1.6431692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4051028e-10 2.2817985e-10 2.609917e-10 ] [ 1.7137167e-10 4.1079967e-10 1.0817813e-10 ] [ 2.3666334e-10 4.4110523e-10 3.4622383e-10 ] [ 3.7384672e-10 2.3572385e-10 3.1713044e-10 ] [ 4.0470799e-10 4.183436e-10 1.6431692e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-06 5.1e-06 -7e-06 ] [ -4.6e-06 -8.7e-06 6.7e-06 ] [ 6e-06 -6e-07 -2.6e-06 ] [ -5.4e-06 6.5e-06 -3.5e-06 ] [ 9e-07 -2.3e-06 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-15 8.17110076608e-15 -1.12152363456e-14 ] [ -7.370012455680001e-15 -1.393893660096e-14 1.073458335936e-14 ] [ 9.6130597248e-15 -9.6130597248e-16 -4.16565921408e-15 ] [ -8.65175375232e-15 1.04141480352e-14 -5.6076181728e-15 ] [ 1.44195895872e-15 -3.68500622784e-15 1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.9991 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.242903073224128e-18 } }