{ "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" [ [ 2.528767 2.719521 3.332257 ] [ 2.679869 4.813542 3.129006 ] [ 6.091314 2.864553 1.221181 ] [ 3.782186 2.699172 1.048642 ] [ 4.900359 1.620716 3.350029 ] [ 4.704911 4.540373 1.710823 ] [ 4.562967 3.751533 4.052534 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.528767e-10 2.719521e-10 3.332257e-10 ] [ 2.679869e-10 4.813542e-10 3.129006e-10 ] [ 6.091314e-10 2.864553e-10 1.221181e-10 ] [ 3.782186e-10 2.699172e-10 1.048642e-10 ] [ 4.900359e-10 1.620716e-10 3.350029e-10 ] [ 4.704911e-10 4.540373e-10 1.710823e-10 ] [ 4.562967000000001e-10 3.751533e-10 4.052534e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7346217 -8.9349411 0.8069316 ] [ -2.4279116 9.135327 0.1860737 ] [ 4.8182397 -3.5133346 -1.3367954 ] [ -4.9606216 -8.5629571 -5.5183845 ] [ 1.2741647 -4.3359923 -0.7915219 ] [ 2.5507374 12.156237 0.2583199 ] [ 3.4800132 4.0556612 6.3953765 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.585700196072353e-09 -1.431535373864504e-08 1.292846944104737e-09 ] [ -3.889943202889122e-09 1.4636407342763e-08 2.981229318857529e-10 ] [ 7.719671000750407e-09 -5.628982557167719e-09 -2.141782336672985e-09 ] [ -7.947791952155489e-09 -1.371936967053337e-08 -8.841426630485098e-09 ] [ 2.041436893388646e-09 -6.94702549102882e-09 -1.268157883031195e-09 ] [ 4.086731828080178e-09 1.947643871830393e-08 4.138741044673939e-10 ] [ 5.575595789115395e-09 6.497885556525673e-09 1.024652270951373e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.607107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.859663547052402e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4863599 2.521137 3.3797389 ] [ 2.5768772 5.0622795 3.0831569 ] [ 6.237096 2.7584175 1.3304651 ] [ 3.6462887 2.5371268 1.0831838 ] [ 4.9308687 1.4872904 3.1281236 ] [ 4.7331653 4.8006213 1.7177457 ] [ 4.6397172 3.8425375 4.122058 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4863599e-10 2.521137e-10 3.3797389e-10 ] [ 2.5768772e-10 5.0622795e-10 3.0831569e-10 ] [ 6.237096000000001e-10 2.7584175e-10 1.3304651e-10 ] [ 3.6462887e-10 2.5371268e-10 1.0831838e-10 ] [ 4.9308687e-10 1.4872904e-10 3.1281236e-10 ] [ 4.7331653e-10 4.800621300000001e-10 1.7177457e-10 ] [ 4.6397172e-10 3.8425375e-10 4.122058e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-06 -1.25e-05 1.93e-05 ] [ 9e-07 6.4e-06 -3.9e-06 ] [ -5.9e-06 -5.6e-06 2.5e-06 ] [ 1.8e-05 1.47e-05 4.8e-06 ] [ 1.4e-06 -4.2e-06 -7e-07 ] [ -0.0 1.05e-05 -1.01e-05 ] [ -7.5e-06 -9.3e-06 -1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-14 -2.002720776e-14 3.092200878144e-14 ] [ 1.44195895872e-15 1.025393037312e-14 -6.24848882112e-15 ] [ -9.45284206272e-15 -8.972189076479999e-15 4.005441552e-15 ] [ 2.88391791744e-14 2.355199632576e-14 7.69044777984e-15 ] [ 2.24304726912e-15 -6.72914180736e-15 -1.12152363456e-15 ] [ 0.0 1.68228545184e-14 -1.618198387008e-14 ] [ -1.2016324656e-14 -1.490024257344e-14 -1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.961949 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.717603813100194e-18 } }