{ "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" [ [ 0.5485971 0.5343947 2.664941 ] [ 1.37313 2.35631 1.443365 ] [ 2.145447 0.6526892 0.5854964 ] [ 2.929696 0.0722677 2.986283 ] [ 2.995983 2.738917 0.2990299 ] [ 2.823077 2.78342 2.858653 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.485971e-11 5.343947e-11 2.664941e-10 ] [ 1.37313e-10 2.35631e-10 1.443365e-10 ] [ 2.145447e-10 6.526892e-11 5.854964e-11 ] [ 2.929696e-10 7.22677e-12 2.986283e-10 ] [ 2.995983e-10 2.738917e-10 2.990299e-11 ] [ 2.823077e-10 2.78342e-10 2.858653e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4939818 -2.3755991 1.722004 ] [ -29.8999966 5.1294716 0.9135699 ] [ -7.2620028 -36.9220737 -1.1665359 ] [ 2.447577 -0.3641314 0.4151897 ] [ 26.2099764 30.9611319 -16.5820156 ] [ 11.9984278 3.5712008 14.6977879 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.59797599958126e-09 -3.806129369771429e-09 2.758954572454536e-09 ] [ -4.790507590919944e-08 8.218319542286593e-09 1.463700347305717e-09 ] [ -1.163501120220258e-08 -5.915568376096592e-08 -1.86899656170216e-09 ] [ 3.921450679315817e-09 -5.834028207857076e-10 6.652072360174697e-10 ] [ 4.199301176577144e-08 4.960520209237202e-08 -2.656731793894349e-08 ] [ 1.922360066589602e-08 5.721694477082108e-09 2.354845234486793e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7464015 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.002396944882551e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3938723 0.280447 2.5614554 ] [ 0.8537158 2.6420341 1.5827069 ] [ 2.2041804 0.3899471 0.518686 ] [ 2.9633475 0.2727372 3.0525612 ] [ 3.2375646 2.7581624 0.2538373 ] [ 3.1632495 2.7946709 2.8685215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.938723e-11 2.80447e-11 2.5614554e-10 ] [ 8.537158e-11 2.6420341e-10 1.5827069e-10 ] [ 2.2041804e-10 3.899471e-11 5.18686e-11 ] [ 2.9633475e-10 2.727372e-11 3.0525612e-10 ] [ 3.2375646e-10 2.7581624e-10 2.538373e-11 ] [ 3.1632495e-10 2.7946709e-10 2.8685215e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.11e-05 2.09e-05 -4.96e-05 ] [ -1.24e-05 -5.37e-05 3.4e-05 ] [ 5.1e-06 -1.2e-05 3.54e-05 ] [ -8.25e-05 4.39e-05 -1.2e-05 ] [ -2.08e-05 1.3e-05 1e-06 ] [ 5.94e-05 -1.21e-05 -8.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.187122599739999e-14 3.34854916506e-14 -7.94679610464e-14 ] [ -1.98669902616e-14 -8.603688524579999e-14 5.447400555599999e-14 ] [ 8.1711008334e-15 -1.9226119608e-14 5.671705284359999e-14 ] [ -1.32179572305e-13 7.03355542326e-14 -1.9226119608e-14 ] [ -3.332527398719999e-14 2.082829624199999e-14 1.602176634e-15 ] [ 9.51692920596e-14 -1.93863372714e-14 -1.39389367158e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.865808 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.182853339313027e-18 } }