{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.9259009 22.5665045 -47.1010649 ] [ -16.5219511 -24.7422142 49.1336968 ] [ 37.2382395 -0.1809789 -0.870563 ] [ 11.5367308 -0.6078835 -33.0517645 ] [ -11.3271184 2.9645721 31.8896956 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.352698946737956e-08 3.615552622095585e-08 -7.546422561929754e-08 ] [ -2.64710840005106e-08 -3.964139746466299e-08 7.872086095500056e-08 ] [ 5.966223721819584e-08 -2.899601648270225e-10 -1.394795697024942e-09 ] [ 1.848388052050813e-08 -9.739367398941389e-10 -5.295476479437068e-08 ] [ -1.814804443103146e-08 4.749768148428311e-09 5.109292515569261e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.5004518 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.201704861840324e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6682146 1.5740349 1.3037821 ] [ 1.1833352 -0.5832245 2.595379 ] [ 3.2290512 0.9548748 2.4039723 ] [ 2.9394258 2.1680287 0.0561594 ] [ 2.2230824 3.4156413 2.4256978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.682146e-11 1.5740349e-10 1.3037821e-10 ] [ 1.1833352e-10 -5.832245e-11 2.595379e-10 ] [ 3.2290512e-10 9.548748e-11 2.4039723e-10 ] [ 2.9394258e-10 2.1680287e-10 5.61594e-12 ] [ 2.2230824e-10 3.4156413e-10 2.4256978e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.36e-05 -3.32e-05 5.64e-05 ] [ -9.9e-06 -2.67e-05 8.1e-06 ] [ -0.0001058 4.1e-05 -6.79e-05 ] [ 3.2e-05 5.2e-06 9.4e-06 ] [ 1.01e-05 1.36e-05 -5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.179202002624e-13 -5.31922642488e-14 9.03627621576e-14 ] [ -1.58615486766e-14 -4.277811612779999e-14 1.29776307354e-14 ] [ -1.695102878772e-13 6.568924199399999e-14 -1.087877934486e-13 ] [ 5.126965228799999e-14 8.331318496799998e-15 1.50604603596e-14 ] [ 1.61819840034e-14 2.17896022224e-14 -9.452842140600001e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.801245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.531638552710933e-18 } }