{ "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" [ [ 2.476712 2.310837 1.57832 ] [ 2.970546 4.476183 1.171414 ] [ 2.629523 3.538885 3.808943 ] [ 5.406765 3.077785 1.539132 ] [ 4.254834 1.46676 3.134429 ] [ 4.456572 4.8029 2.877728 ] [ 4.871099 3.222036 4.56833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.476712e-10 2.310837e-10 1.57832e-10 ] [ 2.970546e-10 4.476183e-10 1.171414e-10 ] [ 2.629523e-10 3.538885e-10 3.808943e-10 ] [ 5.406765000000001e-10 3.077785e-10 1.539132e-10 ] [ 4.254834e-10 1.46676e-10 3.134429e-10 ] [ 4.456572000000001e-10 4.8029e-10 2.877728e-10 ] [ 4.871099000000001e-10 3.222036e-10 4.56833e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8694836 -0.584003 1.306882 ] [ 0.2949293 0.0760655 -0.1638328 ] [ -0.1977122 -0.5514532 -0.7963801 ] [ -1.4752272 -0.2612363 1.0002653 ] [ -0.2987026 1.1882782 -1.126631 ] [ 0.7613087 0.3909419 0.0939121 ] [ 0.0459204 -0.2585931 -0.3142155 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.393066296089019e-09 -9.356759530770624e-10 2.093855786544346e-09 ] [ 4.725288292489094e-10 1.218703657494624e-10 -2.624890818802022e-10 ] [ -3.167698644869338e-10 -8.835254245053465e-10 -1.275941577490366e-09 ] [ -2.363574530208246e-09 -4.18546692364295e-10 1.602601678257498e-09 ] [ -4.785743222921741e-10 1.903831551046307e-09 -1.805061848468525e-09 ] [ 1.219751000351641e-09 6.263579722711315e-10 1.504637710302317e-10 ] [ 7.357259129778432e-11 -4.143118191201965e-10 -5.034287279929824e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.608935085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.379303452408904e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7498674 2.1812313 1.4992062 ] [ 3.0512819 4.4480138 1.3453072 ] [ 2.7417956 3.4800434 3.5476728 ] [ 4.9913609 3.0614966 1.788987 ] [ 3.9916936 1.4201533 3.2688013 ] [ 4.4794217 5.0878843 3.0197693 ] [ 5.06063 3.2165632 4.2085522 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7498674e-10 2.1812313e-10 1.4992062e-10 ] [ 3.0512819e-10 4.4480138e-10 1.3453072e-10 ] [ 2.7417956e-10 3.4800434e-10 3.5476728e-10 ] [ 4.9913609e-10 3.0614966e-10 1.788987e-10 ] [ 3.9916936e-10 1.4201533e-10 3.2688013e-10 ] [ 4.4794217e-10 5.0878843e-10 3.0197693e-10 ] [ 5.06063e-10 3.2165632e-10 4.2085522e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.26e-05 2.3e-06 1.51e-05 ] [ 9.2e-06 -7.7e-06 1.08e-05 ] [ 2.26e-05 -4.9e-06 -2.2e-05 ] [ 1.59e-05 -7e-06 -2.52e-05 ] [ 6.2e-06 2.31e-05 -2.7e-06 ] [ -1.05e-05 -1.74e-05 1.83e-05 ] [ -2.07e-05 1.16e-05 5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.620919163008e-14 3.68500622784e-15 2.419286697408e-14 ] [ 1.474002491136e-14 -1.233675998016e-14 1.730350750464e-14 ] [ 3.620919163008e-14 -7.850665441919999e-15 -3.52478856576e-14 ] [ 2.547460827072e-14 -1.12152363456e-14 -4.037485084416e-14 ] [ 9.93349504896e-15 3.701027994048e-14 -4.32587687616e-15 ] [ -1.68228545184e-14 -2.787787320192e-14 2.931983216064e-14 ] [ -3.316505605055999e-14 1.858524880128e-14 9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }