{ "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" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.107878 -3.1395125 -0.6753387 ] [ -4.3186165 0.3712613 1.2272758 ] [ -3.3256187 -2.7515009 -1.1885913 ] [ 2.022228 -0.62534 0.5335563 ] [ 1.9259347 -1.8014615 0.7857833 ] [ 6.0506959 2.6917292 -2.3157375 ] [ 1.7532546 5.2548244 1.6330521 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.581546092698664e-09 -5.030053528209359e-09 -1.082011876261465e-09 ] [ -6.919186390501124e-09 5.948261750678151e-10 1.966312594033617e-09 ] [ -5.32822853083529e-09 -4.408390414090159e-09 -1.904333192546279e-09 ] [ 3.239966423527143e-09 -1.001905128051072e-09 8.54851429740551e-10 ] [ 3.085687549527461e-09 -2.886259498571299e-09 1.258963632275073e-09 ] [ 9.694283510550414e-09 4.312625593764688e-09 -3.71022048240984e-09 ] [ 2.809023530430056e-09 8.419156800089388e-09 2.616437895168344e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.27923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.249090819382598e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3971817 2.9158061 0.0026481 ] [ 1.7133766 4.9988648 1.2529918 ] [ 2.4458209 2.8780963 2.6394223 ] [ 4.4168133 1.9394894 1.159366 ] [ 4.9812183 3.4191706 3.1245866 ] [ 4.2817741 4.5552216 0.8493837 ] [ 3.3104102 5.3099752 3.1824403 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3971817e-10 2.9158061e-10 2.6481e-13 ] [ 1.7133766e-10 4.9988648e-10 1.2529918e-10 ] [ 2.445820900000001e-10 2.8780963e-10 2.6394223e-10 ] [ 4.416813300000001e-10 1.9394894e-10 1.159366e-10 ] [ 4.9812183e-10 3.4191706e-10 3.124586600000001e-10 ] [ 4.2817741e-10 4.555221600000001e-10 8.493837e-11 ] [ 3.3104102e-10 5.3099752e-10 3.1824403e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.53e-05 -4.94e-05 -3.97e-05 ] [ -4.57e-05 5.76e-05 -2.63e-05 ] [ 5.51e-05 2.07e-05 2.52e-05 ] [ 4.2e-06 9.9e-06 5.8e-06 ] [ -1.73e-05 -8.9e-06 -1.86e-05 ] [ 1.75e-05 -9.2e-06 2.77e-05 ] [ 1.5e-06 -2.07e-05 2.59e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.451330229824e-14 -7.914752506752001e-14 -6.360641184576e-14 ] [ -7.321947157056e-14 9.228537335808e-14 -4.213724512704e-14 ] [ 8.827993180608e-14 3.316505605055999e-14 4.037485084416e-14 ] [ 6.72914180736e-15 1.586154854592e-14 9.292624400640001e-15 ] [ -2.771765553984e-14 -1.425937192512e-14 -2.980048514688e-14 ] [ 2.8038090864e-14 -1.474002491136e-14 4.438029239616e-14 ] [ 2.4032649312e-15 -3.316505605055999e-14 4.149637447872e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.454184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917992188554143e-18 } }