{ "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" [ [ 1.691051 2.220945 1.919277 ] [ 2.666072 2.808957 4.219459 ] [ 1.090931 4.286689 3.184511 ] [ 3.947256 1.730986 2.765408 ] [ 5.245402 2.932614 3.956238 ] [ 3.932067 4.011287 2.276365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.691051e-10 2.220945e-10 1.919277e-10 ] [ 2.666072e-10 2.808957e-10 4.219459e-10 ] [ 1.090931e-10 4.286689e-10 3.184511e-10 ] [ 3.947256e-10 1.730986e-10 2.765408e-10 ] [ 5.245402000000001e-10 2.932614e-10 3.956238e-10 ] [ 3.932067e-10 4.011287e-10 2.276365e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1550558 1.9211308 1.360018 ] [ -0.6539547 0.7269112 1.0071877 ] [ 2.3920842 -1.2015722 -1.2367157 ] [ -0.5536437 -3.1310673 -2.7033885 ] [ 0.2517589 1.6959087 1.1357942 ] [ -2.5913007 -0.0113112 0.4371043 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.850603398479441e-09 3.077990853258801e-09 2.178989043467175e-09 ] [ -1.047750931402278e-09 1.164640130037673e-09 1.613692585697324e-09 ] [ 3.832541380225072e-09 -1.925130887043222e-09 -1.981436981116307e-09 ] [ -8.87034992393209e-10 -5.01652282621138e-09 -4.331305851639581e-09 ] [ 4.033622236583252e-10 2.717145270151321e-09 1.81974291328024e-09 ] [ -4.151721399002675e-09 -1.812254019319296e-11 7.003182903111495e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.98277 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.842463339602361e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8234266 2.335793 2.0602578 ] [ 2.593835 2.5291499 4.4013644 ] [ 1.6066379 4.3675759 3.1968316 ] [ 3.9956865 1.5735185 2.6032457 ] [ 4.8680689 3.2231202 4.0120571 ] [ 3.6851241 3.9623205 2.0475014 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8234266e-10 2.335793e-10 2.0602578e-10 ] [ 2.593835e-10 2.5291499e-10 4.401364400000001e-10 ] [ 1.6066379e-10 4.367575900000001e-10 3.1968316e-10 ] [ 3.9956865e-10 1.5735185e-10 2.6032457e-10 ] [ 4.8680689e-10 3.2231202e-10 4.0120571e-10 ] [ 3.6851241e-10 3.9623205e-10 2.0475014e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.06e-05 -5.91e-05 -1.24e-05 ] [ 3.2e-06 1e-06 2.14e-05 ] [ -4.29e-05 7.16e-05 -3.5e-06 ] [ 3.5e-06 6e-07 -1.25e-05 ] [ 3.97e-05 -4.51e-05 3e-05 ] [ -2.41e-05 3.1e-05 -2.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.300483838848e-14 -9.468863828927999e-14 -1.986699009792e-14 ] [ 5.126965186560001e-15 1.6021766208e-15 3.428657968511999e-14 ] [ -6.873337703232e-14 1.1471584604928e-13 -5.6076181728e-15 ] [ 5.6076181728e-15 9.6130597248e-16 -2.002720776e-14 ] [ 6.360641184576e-14 -7.225816559807999e-14 4.8065298624e-14 ] [ -3.861245656128e-14 4.96674752448e-14 -3.701027994048e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.320379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.216989588439529e-18 } }