{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.151329 -23.8057862 6.4272221 ] [ -15.3758956 22.6642283 -5.156725 ] [ 2.2881023 0.4232739 2.3995242 ] [ -0.3775129 -0.6787938 -0.8082015 ] [ 14.4995267 -0.1947821 -3.4932349 ] [ -2.1855494 1.59186 0.6314152 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.844632421846586e-09 -3.814107440363965e-08 1.029754507014841e-08 ] [ -2.463490065714341e-08 3.631209700990154e-08 -8.261984302963649e-09 ] [ 3.665944041261657e-09 6.781595523620524e-10 3.844461605957543e-09 ] [ -6.048423474135785e-10 -1.087547565664069e-09 -1.294881558863751e-09 ] [ 2.323080288279913e-08 -3.120753293414514e-10 -5.596779333853326e-09 ] [ -3.501636181132719e-09 2.55044089659924e-09 1.011638679792437e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7967807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.083113321962163e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8654745 0.3313581 0.7951456 ] [ 1.1816077 2.6269573 0.6166752 ] [ 1.5560222 3.4443263 2.7598748 ] [ 1.0436585 -0.2647095 3.032848 ] [ 1.1365686 3.8589029 -1.3194421 ] [ 1.4719177 1.6658823 4.2513368 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.654745e-11 3.313581e-11 7.951456e-11 ] [ 1.1816077e-10 2.6269573e-10 6.166752e-11 ] [ 1.5560222e-10 3.444326300000001e-10 2.7598748e-10 ] [ 1.0436585e-10 -2.647095e-11 3.032848e-10 ] [ 1.1365686e-10 3.8589029e-10 -1.3194421e-10 ] [ 1.4719177e-10 1.6658823e-10 4.2513368e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.22e-05 -7.83e-05 3.89e-05 ] [ 3.64e-05 1.43e-05 -5.31e-05 ] [ 2.96e-05 -5.91e-05 9.63e-05 ] [ -2.64e-05 1.42e-05 -1.05e-05 ] [ -4.06e-05 3.7e-05 -2.5e-06 ] [ -2.11e-05 7.18e-05 -6.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.55683212748e-14 -1.254504304422e-13 6.232467106259999e-14 ] [ 5.831922947759999e-14 2.29111258662e-14 -8.507557926539999e-14 ] [ 4.74244283664e-14 -9.468863906939999e-14 1.542896098542e-13 ] [ -4.22974631376e-14 2.27509082028e-14 -1.6822854657e-14 ] [ -6.504837134039999e-14 5.9280535458e-14 -4.005441585e-15 ] [ -3.38059269774e-14 1.150362823212e-13 -1.107104054094e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.0983 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.41901434731222e-18 } }