{ "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" [ [ 0.0964554 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.0320969 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.64554e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.20969e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.508321 -21.4650009 -23.665297 ] [ -11.1326435 -18.8487771 27.2273205 ] [ 10.4184828 33.2752415 -21.0138984 ] [ -11.3924746 18.7407869 16.3433825 ] [ 16.6194273 -13.9577222 -7.585715 ] [ 15.995529 2.2554719 8.6942072 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.285795243806168e-08 -3.439072260743096e-08 -3.791598557768838e-08 ] [ -1.783646114340109e-08 -3.019907000029042e-08 4.362297635212857e-08 ] [ 1.669224956636692e-08 5.331281398277392e-08 -3.366797672834652e-08 ] [ -1.825275645717783e-08 3.002605062657491e-08 2.618498534629186e-08 ] [ 2.662725787114527e-08 -2.236273618846114e-08 -1.215365522505187e-08 ] [ 2.56276626011284e-08 3.613664347051355e-09 1.392965551223103e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 19.895786 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.187656318163995e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1598289 0.6254725 0.8246409 ] [ 0.2517424 0.7791418 3.3164197 ] [ 1.0792686 2.9228671 1.1678048 ] [ -0.3678424 3.0041767 2.9946706 ] [ 2.3813216 -0.063696 0.9925884 ] [ 2.5360638 1.553438 2.6656435 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.598289e-11 6.254725e-11 8.246409e-11 ] [ 2.517424e-11 7.791418e-11 3.3164197e-10 ] [ 1.0792686e-10 2.9228671e-10 1.1678048e-10 ] [ -3.678424e-11 3.0041767e-10 2.9946706e-10 ] [ 2.3813216e-10 -6.369600000000001e-12 9.925884e-11 ] [ 2.5360638e-10 1.553438e-10 2.6656435e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.58e-05 2.94e-05 7.7e-06 ] [ 3.25e-05 3.45e-05 -1.19e-05 ] [ -5.9e-06 -3.79e-05 2.32e-05 ] [ -3e-07 -2.24e-05 -9.9e-06 ] [ -2.29e-05 7e-06 8.4e-06 ] [ -3.91e-05 -1.07e-05 -1.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.735792302464001e-14 4.710399265152e-14 1.233675998016e-14 ] [ 5.207074017599999e-14 5.52750934176e-14 -1.906590178752e-14 ] [ -9.45284206272e-15 -6.072249392832e-14 3.717049760256e-14 ] [ -4.8065298624e-16 -3.588875630592e-14 -1.586154854592e-14 ] [ -3.668984461632e-14 1.12152363456e-14 1.345828361472e-14 ] [ -6.264510587328001e-14 -1.714328984256e-14 -2.8038090864e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.917847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.749231921287142e-18 } }