{ "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" [ [ 2.55675 2.192965 3.527099 ] [ 1.806278 5.26626 2.450306 ] [ 0.8031725 3.384297 2.630387 ] [ 2.570894 3.149532 1.167105 ] [ 2.627788 4.286276 4.286712 ] [ 4.842075 2.861339 2.293967 ] [ 3.90768 5.002934 2.246314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.55675e-10 2.192965e-10 3.527099e-10 ] [ 1.806278e-10 5.26626e-10 2.450306e-10 ] [ 8.031725e-11 3.384297e-10 2.630387e-10 ] [ 2.570894e-10 3.149532e-10 1.167105e-10 ] [ 2.627788e-10 4.286276e-10 4.286712e-10 ] [ 4.842075000000001e-10 2.861339e-10 2.293967e-10 ] [ 3.90768e-10 5.002934e-10 2.246314e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8713735 -1.9714547 0.2167811 ] [ -3.6612066 5.5470805 -1.3641261 ] [ -4.44881 -2.7726938 -0.2963407 ] [ 1.2658545 -1.3370168 -2.1406829 ] [ 1.5302248 0.516948 3.9118365 ] [ -1.3921564 -0.2387658 0.302322 ] [ 4.8347202 0.2559026 -0.6297898 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.998270870484669e-09 -3.158618629306278e-09 3.473216102513069e-10 ] [ -5.865899618438657e-09 8.887402690795576e-09 -2.185570945243083e-09 ] [ -7.127779372381248e-09 -4.442345182997111e-09 -4.747901413315066e-10 ] [ 2.028122485234474e-09 -2.142137058576829e-09 -3.429752094926344e-09 ] [ 2.451690399128356e-09 8.282419997693183e-10 6.2674529846921e-09 ] [ -2.230480436577093e-09 -3.825449826066087e-10 4.843732403534976e-10 ] [ 7.7460756725495e-09 4.100011629219341e-10 -1.009034493578308e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.103396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.060701444908424e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6489278 2.4409587 3.7714309 ] [ 1.6673996 5.3626934 2.7447758 ] [ 1.0425731 3.2069377 2.1843045 ] [ 2.5196501 2.5902652 0.5268592 ] [ 2.9035148 4.5438344 4.695741 ] [ 4.2303187 2.8833689 2.0424009 ] [ 4.1022534 5.1155447 2.6363777 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6489278e-10 2.4409587e-10 3.7714309e-10 ] [ 1.6673996e-10 5.3626934e-10 2.7447758e-10 ] [ 1.0425731e-10 3.2069377e-10 2.1843045e-10 ] [ 2.5196501e-10 2.5902652e-10 5.268592e-11 ] [ 2.9035148e-10 4.5438344e-10 4.695741e-10 ] [ 4.2303187e-10 2.8833689e-10 2.0424009e-10 ] [ 4.102253400000001e-10 5.1155447e-10 2.6363777e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-07 2.1e-06 3.1e-06 ] [ 1e-05 -6.5e-06 -1.05e-05 ] [ -7.1e-06 -1.3e-06 -1.3e-06 ] [ -3.3e-06 2.7e-06 4e-06 ] [ 6.2e-06 -1.18e-05 -4.8e-06 ] [ -2.7e-06 7.6e-06 7.4e-06 ] [ -2.9e-06 7.1e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-16 3.36457090368e-15 4.96674752448e-15 ] [ 1.6021766208e-14 -1.04141480352e-14 -1.68228545184e-14 ] [ -1.137545400768e-14 -2.08282960704e-15 -2.08282960704e-15 ] [ -5.28718284864e-15 4.32587687616e-15 6.4087064832e-15 ] [ 9.93349504896e-15 -1.890568412544e-14 -7.69044777984e-15 ] [ -4.32587687616e-15 1.217654231808e-14 1.185610699392e-14 ] [ -4.646312200320001e-15 1.137545400768e-14 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.541842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.611601224216751e-18 } }