{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0213932 0.5603914 -0.3020069 ] [ 2.0288501 -3.8289972 -1.8287601 ] [ -4.6241739 -2.577865 4.0309766 ] [ -2.5053637 2.8292101 -3.1815713 ] [ 5.0792944 3.0172607 1.2813617 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.427568488409856e-11 8.97845999577381e-10 -4.838683945002835e-10 ] [ 3.250576197327742e-09 -6.134729794948662e-09 -2.92999667727187e-09 ] [ -7.408743313093556e-09 -4.130195034578593e-09 6.458336467511873e-09 ] [ -4.014035146740985e-09 4.53289427755123e-09 -5.097439154268263e-09 ] [ 8.137926737840364e-09 4.834184552398642e-09 2.052967758528543e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4894012 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039716688563146e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.724382 2.3778318 2.1136539 ] [ 5.0313808 2.00425 2.3842262 ] [ 2.8925013 2.7526891 4.4301691 ] [ 3.4692167 4.6091634 2.0761025 ] [ 4.8710363 3.8662248 3.8133403 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.724382e-10 2.3778318e-10 2.1136539e-10 ] [ 5.0313808e-10 2.00425e-10 2.3842262e-10 ] [ 2.8925013e-10 2.7526891e-10 4.4301691e-10 ] [ 3.4692167e-10 4.6091634e-10 2.0761025e-10 ] [ 4.8710363e-10 3.8662248e-10 3.8133403e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.96e-05 -3.51e-05 -4.76e-05 ] [ 1.2e-06 1.23e-05 3.5e-06 ] [ -3.5e-06 -1.71e-05 4.13e-05 ] [ 2.48e-05 1.25e-05 -1.15e-05 ] [ 2.7e-05 2.75e-05 1.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.946796039168e-14 -5.623639939008e-14 -7.626360715008e-14 ] [ 1.92261194496e-15 1.970677243584e-14 5.6076181728e-15 ] [ -5.6076181728e-15 -2.739722021568e-14 6.616989443904001e-14 ] [ 3.973398019584e-14 2.002720776e-14 -1.84250311392e-14 ] [ 4.32587687616e-14 4.4059857072e-14 2.291112567744e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }