{ "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" [ [ -2.6891349 0.0770453 2.0492343 ] [ -0.6183751 -2.5287385 2.6419226 ] [ -1.7161496 -1.5905982 -3.6085156 ] [ 0.457174 0.85858 0.6697372 ] [ -0.3500608 -0.240139 -0.6342991 ] [ 3.5369756 0.155737 -0.0190975 ] [ 1.379571 3.2681134 -1.098982 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.308469066957346e-09 1.234401784025222e-10 3.283235286001454e-09 ] [ -9.90746128104862e-10 -4.051485704816861e-09 4.23282662368315e-09 ] [ -2.749574766915272e-09 -2.548419249126563e-09 -5.781479330112085e-09 ] [ 7.324734944376192e-10 1.375596803086464e-09 1.073037283920054e-09 ] [ -5.608592296185447e-10 -3.847450915422912e-10 -1.016259188614481e-09 ] [ 5.666859614660053e-09 2.495181803935296e-10 -3.0597568015728e-11 ] [ 2.210316402933677e-09 5.236094883603199e-09 -1.760763267080025e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.246242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.525546855785903e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5882224 2.8088839 0.5181812 ] [ 1.8254945 4.8963917 1.2938677 ] [ 2.1657889 3.1373702 2.8206851 ] [ 4.8622196 2.5653236 1.0040878 ] [ 4.4516065 2.8846133 3.2421737 ] [ 4.0378512 4.6977781 0.5146694 ] [ 3.615412 5.0262632 2.8171738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5882224e-10 2.8088839e-10 5.181812e-11 ] [ 1.8254945e-10 4.8963917e-10 1.2938677e-10 ] [ 2.1657889e-10 3.1373702e-10 2.8206851e-10 ] [ 4.8622196e-10 2.5653236e-10 1.0040878e-10 ] [ 4.4516065e-10 2.8846133e-10 3.2421737e-10 ] [ 4.0378512e-10 4.6977781e-10 5.146694000000001e-11 ] [ 3.615412e-10 5.0262632e-10 2.8171738e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.31e-05 8.9e-06 -1.3e-06 ] [ -4.28e-05 2.13e-05 -4.1e-06 ] [ -3.7e-06 -3.6e-05 2.5e-05 ] [ 1.59e-05 -3.42e-05 1.49e-05 ] [ -2.98e-05 3.78e-05 -1.89e-05 ] [ 1.11e-05 2.57e-05 -1.7e-05 ] [ 3.62e-05 -2.36e-05 1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.098851373248e-14 1.425937192512e-14 -2.08282960704e-15 ] [ -6.857315937023999e-14 3.412636202304e-14 -6.568924145279999e-15 ] [ -5.928053496960001e-15 -5.76783583488e-14 4.005441552e-14 ] [ 2.547460827072e-14 -5.479444043136e-14 2.387243164992e-14 ] [ -4.774486329984001e-14 6.056227626623999e-14 -3.028113813312e-14 ] [ 1.778416049088e-14 4.117593915456e-14 -2.72370025536e-14 ] [ 5.799879367296e-14 -3.781136825088e-14 2.4032649312e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.295431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.853863126525957e-18 } }