{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1779892 2.357943 0.2667025 ] [ 0.683577 1.802827 2.30843 ] [ 1.994264 0.9284256 0.4445094 ] [ 2.959137 1.015728 2.327469 ] [ 2.670153 2.85418 1.122954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.779892e-11 2.357943e-10 2.667025e-11 ] [ 6.83577e-11 1.802827e-10 2.30843e-10 ] [ 1.994264e-10 9.284256e-11 4.445094e-11 ] [ 2.959137e-10 1.015728e-10 2.327469e-10 ] [ 2.670153e-10 2.85418e-10 1.122954e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0478174 0.6439203 -1.3469972 ] [ 0.6872129 -0.2706572 1.8332547 ] [ -1.8438219 -3.0653385 -3.9612691 ] [ 1.1575679 -1.1362978 3.5522843 ] [ -0.0487763 3.8283733 -0.0772727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.661192034744193e-11 1.031674050318522e-09 -2.158127422123062e-09 ] [ 1.101036441892168e-09 -4.336406380911898e-10 2.937197820311718e-09 ] [ -2.954128341099036e-09 -4.911213679538142e-09 -6.346652740717458e-09 ] [ 1.854628226368553e-09 -1.820549769426474e-09 5.691386855894894e-09 ] [ -7.814824750912704e-11 6.133730196954944e-09 -1.238045133660922e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.669931775408902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.482055511291179e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3956727 2.504331 0.219624 ] [ 0.7432892 1.6967721 2.3861824 ] [ 1.854279 0.6829676 0.3681638 ] [ 2.9983701 1.079295 2.3684029 ] [ 2.4935093 2.995738 1.1276919 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.956727e-11 2.504331e-10 2.19624e-11 ] [ 7.432892e-11 1.6967721e-10 2.3861824e-10 ] [ 1.854279e-10 6.829676e-11 3.681638e-11 ] [ 2.9983701e-10 1.079295e-10 2.3684029e-10 ] [ 2.4935093e-10 2.995738e-10 1.1276919e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.12e-05 4.85e-05 -5.76e-05 ] [ 8.9e-06 -2.65e-05 1.55e-05 ] [ 5.4e-06 -1.99e-05 1.45e-05 ] [ 2.57e-05 -1.1e-06 2e-05 ] [ 2.11e-05 -1.1e-06 7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.805320919295999e-14 7.77055661088e-14 -9.228537335808e-14 ] [ 1.425937192512e-14 -4.24576804512e-14 2.48337376224e-14 ] [ 8.65175375232e-15 -3.188331475392e-14 2.32315610016e-14 ] [ 4.117593915456e-14 -1.76239428288e-15 3.2043532416e-14 ] [ 3.380592669888e-14 -1.76239428288e-15 1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.7659997754089005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.238150035698192e-19 } }