{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6796972 -1.9887388 0.4334167 ] [ 0.1738069 3.5837735 -1.2635481 ] [ 0.5053286 -0.0628555 -3.1437351 ] [ -4.3107302 -1.8957081 1.3945864 ] [ 2.5129296 -3.7225926 -1.5141059 ] [ 2.9191284 3.8821859 -1.3928895 ] [ -0.120766 0.2039356 5.4862757 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.691171583863222e-09 -3.186310810237847e-09 6.944101038042874e-10 ] [ 2.784693517137235e-10 5.741838115942589e-09 -2.02442722507626e-09 ] [ 8.096256687415949e-10 -1.007056125886944e-10 -5.03681887920835e-09 ] [ -6.906551145016508e-09 -3.037259197681189e-09 2.234373725765637e-09 ] [ 4.026157054836296e-09 -5.964250832483086e-09 -2.425865074395343e-09 ] [ 4.67695927559331e-09 6.219947486579408e-09 -2.231654992257801e-09 ] [ -1.934884617875328e-10 3.267408504688204e-10 8.789982661803156e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.473348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.158668316950244e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1512172 1.4016372 3.8746678 ] [ 1.9074159 4.7552491 1.847229 ] [ 3.8472798 3.2905522 1.1728304 ] [ 0.8240823 3.5296911 3.6223263 ] [ 3.3933567 1.1344062 1.9240263 ] [ 4.0018552 4.7676218 3.2094839 ] [ 2.9211199 3.5340793 4.9806311 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1512172e-10 1.4016372e-10 3.8746678e-10 ] [ 1.9074159e-10 4.755249100000001e-10 1.847229e-10 ] [ 3.8472798e-10 3.2905522e-10 1.1728304e-10 ] [ 8.240823e-11 3.5296911e-10 3.6223263e-10 ] [ 3.3933567e-10 1.1344062e-10 1.9240263e-10 ] [ 4.0018552e-10 4.7676218e-10 3.2094839e-10 ] [ 2.9211199e-10 3.5340793e-10 4.9806311e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 1.1e-06 -1.65e-05 ] [ 1.24e-05 -3.51e-05 -8.8e-06 ] [ 1.45e-05 3.52e-05 -1.05e-05 ] [ 1.77e-05 2.96e-05 3.01e-05 ] [ -1.02e-05 -1.68e-05 1.45e-05 ] [ -2.88e-05 -5.9e-06 3.4e-06 ] [ -1.01e-05 -8.1e-06 -1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.2097947936e-15 1.76239428288e-15 -2.64359142432e-14 ] [ 1.986699009792e-14 -5.623639939008e-14 -1.409915426304e-14 ] [ 2.32315610016e-14 5.639661705216e-14 -1.68228545184e-14 ] [ 2.835852618816e-14 4.742442797568e-14 4.822551628608e-14 ] [ -1.634220153216e-14 -2.691656722944e-14 2.32315610016e-14 ] [ -4.614268667904e-14 -9.45284206272e-15 5.44740051072e-15 ] [ -1.618198387008e-14 -1.297763062848e-14 -1.954655477376e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.124769 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.90390811492006e-18 } }