{ "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" [ [ -13.8827452 10.7384227 -25.1867185 ] [ -8.4680879 -13.6491597 25.7312174 ] [ 20.5146148 -0.7573323 1.0936405 ] [ 6.5943734 1.5767887 -16.9757958 ] [ -4.7581551 2.0912806 15.3376564 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.224260979196342e-08 1.720484979420801e-08 -4.035357153537085e-08 ] [ -1.356737245625937e-08 -2.186836456490554e-08 4.122595494300216e-08 ] [ 3.286803621727767e-08 -1.213380105236692e-09 1.752205240660022e-09 ] [ 1.056535089030541e-08 2.526293991081625e-09 -2.719822315023483e-08 ] [ -7.623404859360285e-09 3.350600884852597e-09 2.457363450194349e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.7098094 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.739416646704075e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0769416 0.7775449 1.3218831 ] [ 0.2301433 0.0186443 3.461954 ] [ 3.6646896 0.4244312 1.92161 ] [ 2.9760958 3.5893376 -0.0387131 ] [ 2.2952388 2.7193973 2.1182566 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0769416e-10 7.775449e-11 1.3218831e-10 ] [ 2.301433e-11 1.86443e-12 3.461954e-10 ] [ 3.6646896e-10 4.244312e-11 1.92161e-10 ] [ 2.9760958e-10 3.5893376e-10 -3.87131e-12 ] [ 2.2952388e-10 2.7193973e-10 2.1182566e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.14e-05 -1.92e-05 8.39e-05 ] [ 2.72e-05 6.8e-06 -6.68e-05 ] [ -9.4e-06 5.74e-05 -1.63e-05 ] [ 2.19e-05 -3.04e-05 2.72e-05 ] [ 1.18e-05 -1.46e-05 -2.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.235187830912e-14 -3.076179111936e-14 1.3442261848512e-13 ] [ 4.357920408576e-14 1.089480102144e-14 -1.0702539826944e-13 ] [ -1.506046023552e-14 9.196493803392e-14 -2.611547891904e-14 ] [ 3.508766799552e-14 -4.870616927232e-14 4.357920408576e-14 ] [ 1.890568412544e-14 -2.339177866368e-14 -4.470072772032e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.457292 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835660538007888e-18 } }