{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.051773 2.11113 1.612774 ] [ 4.096623 0.6333142 0.1280934 ] [ 4.940584 2.852779 0.2569481 ] [ 3.858102 4.269978 1.799879 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.051773e-10 2.11113e-10 1.612774e-10 ] [ 4.096623e-10 6.333142000000001e-11 1.280934e-11 ] [ 4.940584000000001e-10 2.852779e-10 2.569481e-11 ] [ 3.858102e-10 4.269978e-10 1.799879e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.190136 -0.7129184 0.7347206 ] [ 0.1955771 -0.1087034 -0.2028433 ] [ 0.7922414 0.1721895 -0.6335879 ] [ 0.2023175 0.6494324 0.1017106 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.906808074772429e-09 -1.142221193018143e-09 1.177152168140148e-09 ] [ 3.133490571838637e-10 -1.741620460814708e-10 -3.249907929459207e-10 ] [ 1.269310649109861e-09 2.758779912472416e-10 -1.015119720601768e-09 ] [ 3.24148368478704e-10 1.040505408070034e-09 1.629583454075405e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8545622 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.578874916505941e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7302254 1.9714446 1.849275 ] [ 4.082531 0.9947261 0.2727827 ] [ 5.2433189 2.9621569 0.049575 ] [ 3.8910067 3.9388736 1.6260618 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7302254e-10 1.9714446e-10 1.849275e-10 ] [ 4.082531000000001e-10 9.947261e-11 2.727827e-11 ] [ 5.2433189e-10 2.9621569e-10 4.9575e-12 ] [ 3.8910067e-10 3.9388736e-10 1.6260618e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.03e-05 -4.04e-05 -1.18e-05 ] [ -4.5e-06 1.05e-05 1.27e-05 ] [ -1.36e-05 -1.5e-06 6.8e-06 ] [ 2.84e-05 3.15e-05 -7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.650241919424e-14 -6.472793548032e-14 -1.890568412544e-14 ] [ -7.2097947936e-15 1.68228545184e-14 2.034764308416e-14 ] [ -2.178960204288e-14 -2.4032649312e-15 1.089480102144e-14 ] [ 4.550181603071999e-14 5.04685635552e-14 -1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.834722 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735913828126742e-18 } }