{ "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" [ [ 2.510917 2.898515 1.87318 ] [ 1.068289 2.930408 3.679489 ] [ 1.738918 4.773151 2.611531 ] [ 3.136153 2.016935 3.60422 ] [ 3.930075 4.659698 3.066974 ] [ 4.662989 3.229538 1.53666 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.510917e-10 2.898515000000001e-10 1.87318e-10 ] [ 1.068289e-10 2.930408e-10 3.679489e-10 ] [ 1.738918e-10 4.773151000000001e-10 2.611531e-10 ] [ 3.136153000000001e-10 2.016935e-10 3.604220000000001e-10 ] [ 3.930075e-10 4.659698e-10 3.066974e-10 ] [ 4.662989e-10 3.229538e-10 1.53666e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5536198 -6.3599669 -13.0179402 ] [ -7.0176498 -1.079019 6.0376662 ] [ -3.0663604 6.871783 -0.2882596 ] [ 2.3916744 -7.1553292 6.7649904 ] [ 5.2885894 7.5352485 4.0667569 ] [ 4.9573662 0.1872836 -3.5632137 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.091349941971972e-09 -1.018979027624185e-08 -2.085703943941247e-08 ] [ -1.12435144425218e-08 -1.728779015198995e-09 9.673407629834377e-09 ] [ -4.912850943826938e-09 1.100981006581089e-08 -4.618427918411597e-10 ] [ 3.831884808245867e-09 -1.146410115836757e-08 1.083870945881644e-08 ] [ 8.4732542936907e-09 1.207279897861827e-08 6.515662827657083e-09 ] [ 7.942576226384138e-09 3.000614053792588e-10 -5.708897685054265e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.5635735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.709474148202429e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5897721 2.5547326 1.3184013 ] [ 1.0194328 3.2143741 4.1012992 ] [ 1.7461301 4.6400848 2.4049988 ] [ 3.031864 2.0948841 3.7338135 ] [ 3.9971277 4.3824606 3.4574889 ] [ 4.6630143 3.6217088 1.3560524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5897721e-10 2.5547326e-10 1.3184013e-10 ] [ 1.0194328e-10 3.2143741e-10 4.1012992e-10 ] [ 1.7461301e-10 4.6400848e-10 2.4049988e-10 ] [ 3.031864e-10 2.0948841e-10 3.7338135e-10 ] [ 3.9971277e-10 4.3824606e-10 3.4574889e-10 ] [ 4.663014300000001e-10 3.6217088e-10 1.3560524e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.83e-05 4.7e-05 5.37e-05 ] [ -7.2e-06 -8.7e-06 5.4e-06 ] [ 4.8e-06 -1.79e-05 2e-07 ] [ -1.68e-05 1.35e-05 -1.31e-05 ] [ -9.9e-06 -3.1e-05 -5e-05 ] [ -9.1e-06 -2.9e-06 3.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.136336457664001e-14 7.530230117759999e-14 8.603688453696e-14 ] [ -1.153567166976e-14 -1.393893660096e-14 8.65175375232e-15 ] [ 7.69044777984e-15 -2.867896151232001e-14 3.2043532416e-16 ] [ -2.691656722944e-14 2.16293843808e-14 -2.098851373248e-14 ] [ -1.586154854592e-14 -4.96674752448e-14 -8.010883104e-14 ] [ -1.457980724928e-14 -4.646312200320001e-15 5.928053496960001e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.917847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.749231921287142e-18 } }