{ "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" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2219767 -1.673127 -2.7546261 ] [ -1.5175056 1.5075855 0.2035224 ] [ 2.7987351 1.2914324 -3.3358628 ] [ -2.1796654 -3.9698301 0.4925848 ] [ 1.8515904 -1.8011226 0.7875021 ] [ 1.2171185 2.7722503 4.1506854 ] [ 0.0517037 1.8728116 0.4561941 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.559999120702335e-09 -2.680644963029242e-09 -4.413397536465483e-09 ] [ -2.431311994253077e-09 2.415418241957078e-09 3.260788310891059e-10 ] [ 4.48406794503235e-09 2.069102798623634e-09 -5.344641388356427e-09 ] [ -3.492208945046681e-09 -6.360368974768127e-09 7.892078503214439e-10 ] [ 2.96657485017772e-09 -2.88571652091451e-09 1.261717453450904e-09 ] [ 1.950038805443165e-09 4.441634617665786e-09 6.650131108175897e-09 ] [ 8.283845934885695e-11 3.000574960683041e-09 7.309035215668973e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.536763 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.047304885431047e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1860903 1.7469635 1.7843058 ] [ 2.3828881 4.0497473 2.1595138 ] [ 5.6261931 2.738705 1.1992361 ] [ 4.37266 0.9522833 2.037774 ] [ 4.801426 1.1081853 4.3331382 ] [ 4.9982216 3.4109679 4.7083574 ] [ 4.6631048 4.3510518 2.5915674 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1860903e-10 1.7469635e-10 1.7843058e-10 ] [ 2.3828881e-10 4.0497473e-10 2.1595138e-10 ] [ 5.6261931e-10 2.738705e-10 1.1992361e-10 ] [ 4.37266e-10 9.522833000000001e-11 2.037774e-10 ] [ 4.801426000000001e-10 1.1081853e-10 4.3331382e-10 ] [ 4.9982216e-10 3.4109679e-10 4.708357399999999e-10 ] [ 4.6631048e-10 4.3510518e-10 2.5915674e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.39e-05 6.2e-06 2e-07 ] [ -2.79e-05 2.34e-05 5.4e-06 ] [ -2.5e-06 -9.8e-06 2.72e-05 ] [ -9.7e-06 -2.4e-05 -1.23e-05 ] [ 9.4e-06 -3e-06 6.1e-06 ] [ -2.4e-06 2.7e-06 -3.89e-05 ] [ -7e-07 4.5e-06 1.22e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.431378744512e-14 9.93349504896e-15 3.2043532416e-16 ] [ -4.470072772032e-14 3.749093292672001e-14 8.65175375232e-15 ] [ -4.005441552e-15 -1.570133088384e-14 4.357920408576e-14 ] [ -1.554111322176e-14 -3.84522388992e-14 -1.970677243584e-14 ] [ 1.506046023552e-14 -4.8065298624e-15 9.77327738688e-15 ] [ -3.84522388992e-15 4.32587687616e-15 -6.232467054911999e-14 ] [ -1.12152363456e-15 7.2097947936e-15 1.954655477376e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.777266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.886926024214273e-18 } }