{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.7901488 -0.4871252 -7.996191 ] [ -5.0528419 -1.3903537 0.539261 ] [ -3.0898684 4.9097646 1.7213111 ] [ 1.4760493 -2.1827088 -1.2451735 ] [ 2.5095511 -5.510721 3.9295921 ] [ 6.7685968 3.9532598 1.0084747 ] [ 0.1786618 0.7078842 2.0427256 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.470311175913175e-09 -7.804606068425242e-10 -1.281131027565137e-08 ] [ -8.095545160778651e-09 -2.227592192782777e-09 8.639913667092289e-10 ] [ -4.950514911828703e-09 7.866310055751464e-09 2.757844401543531e-09 ] [ 2.364891679608206e-09 -3.497085009374423e-09 -1.994987870539709e-09 ] [ 4.020744101122923e-09 -8.829148349951598e-09 6.295900591900376e-09 ] [ 1.084448754858169e-08 6.333820427508484e-09 1.615754587008294e-09 ] [ 2.862477589900454e-10 1.134155515473711e-09 3.272807199029652e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.80577 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.532363516774202e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5435934 2.6903647 1.1571625 ] [ 1.2055806 1.7980545 3.0715523 ] [ 1.9737218 4.1649209 3.3150703 ] [ 4.4267127 1.3591545 2.1231176 ] [ 3.1956016 0.9478987 4.1779339 ] [ 4.5181958 3.8181836 2.5659907 ] [ 3.7052192 3.225813 4.8549957 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5435934e-10 2.6903647e-10 1.1571625e-10 ] [ 1.2055806e-10 1.7980545e-10 3.0715523e-10 ] [ 1.9737218e-10 4.1649209e-10 3.3150703e-10 ] [ 4.426712700000001e-10 1.3591545e-10 2.1231176e-10 ] [ 3.1956016e-10 9.478987e-11 4.1779339e-10 ] [ 4.5181958e-10 3.8181836e-10 2.5659907e-10 ] [ 3.705219200000001e-10 3.225813e-10 4.8549957e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.91e-05 -1.99e-05 -6.48e-05 ] [ -5.31e-05 -2.4e-05 -2.13e-05 ] [ -3.1e-05 2.7e-06 3.93e-05 ] [ 6.5e-06 -1.19e-05 2.73e-05 ] [ -9.4e-06 -1.38e-05 -1.1e-06 ] [ 6.8e-05 4.31e-05 3e-06 ] [ 4.81e-05 2.38e-05 1.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.662333966527999e-14 -3.188331475392e-14 -1.0382104502784e-13 ] [ -8.507557856448001e-14 -3.84522388992e-14 -3.412636202304e-14 ] [ -4.96674752448e-14 4.32587687616e-15 6.296554119743999e-14 ] [ 1.04141480352e-14 -1.906590178752e-14 4.373942174784e-14 ] [ -1.506046023552e-14 -2.211003736704e-14 -1.76239428288e-15 ] [ 1.089480102144e-13 6.905381235648e-14 4.8065298624e-15 ] [ 7.706469546047999e-14 3.813180357504e-14 2.8038090864e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }