{ "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" [ [ -4.308469102453926e-09 1.234401794195202e-10 3.283235313051346e-09 ] [ -9.907461362674131e-10 -4.051485738196208e-09 4.232826658556528e-09 ] [ -2.749574789568446e-09 -2.548419270122458e-09 -5.781479377744489e-09 ] [ 7.32473500472316e-10 1.37559681441972e-09 1.073037292760585e-09 ] [ -5.608592342393471e-10 -3.847450947121259e-10 -1.016259196987229e-09 ] [ 5.666859661348129e-09 2.49518182449258e-10 -3.0597568267815e-11 ] [ 2.210316421144014e-09 5.236094926742294e-09 -1.760763281586588e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.246242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.525546893070942e-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" [ [ 2.09885139054e-14 1.42593720426e-14 -2.0828296242e-15 ] [ -6.857315993519999e-14 3.41263623042e-14 -6.568924199399999e-15 ] [ -5.9280535458e-15 -5.7678358824e-14 4.005441585e-14 ] [ 2.54746084806e-14 -5.479444088279999e-14 2.38724318466e-14 ] [ -4.77448636932e-14 6.056227676519999e-14 -3.02811383826e-14 ] [ 1.77841606374e-14 4.11759394938e-14 -2.723700277799999e-14 ] [ 5.799879415079998e-14 -3.78113685624e-14 2.403264951e-15 ] ] } "relaxed-potential-energy" { "source-value" -30.295431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.853863166515925e-18 } }