{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.61188 5.080623 2.93239 ] [ 4.855786 1.762639 3.084137 ] [ 3.780411 3.32193 1.747479 ] [ 4.346291 4.090656 3.759617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61188e-10 5.080623e-10 2.93239e-10 ] [ 4.855786000000001e-10 1.762639e-10 3.084137e-10 ] [ 3.780411e-10 3.32193e-10 1.747479e-10 ] [ 4.346291e-10 4.090656e-10 3.759617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5492697 0.4144692 -1.4356192 ] [ -0.3197864 1.304477 0.3537236 ] [ -0.7550442 0.2732033 -0.6126491 ] [ 2.6241002 -1.9921495 1.6945447 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.482203713104189e-09 6.640528677526728e-10 -2.300115537561773e-09 ] [ -5.123542979509776e-10 2.090002568990418e-09 5.667276868143625e-10 ] [ -1.209714174877223e-09 4.377199435916921e-10 -9.815720728611293e-10 ] [ 4.204272025714726e-09 -3.191775380334783e-09 2.714959923608539e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.715499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.037247538745036e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.615807 4.1019276 3.1507937 ] [ 3.93776 2.2079649 3.2901998 ] [ 4.1621526 3.6456229 1.4910662 ] [ 4.8786485 4.3003326 3.5915633 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.615807e-10 4.1019276e-10 3.1507937e-10 ] [ 3.93776e-10 2.2079649e-10 3.2901998e-10 ] [ 4.1621526e-10 3.6456229e-10 1.4910662e-10 ] [ 4.8786485e-10 4.3003326e-10 3.5915633e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-06 7.7e-06 -3.5e-06 ] [ 7.7e-06 -2.5e-06 -2.4e-06 ] [ 1.8e-06 3.4e-06 2.36e-05 ] [ -1.11e-05 -8.6e-06 -1.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.5634826144e-15 1.23367600818e-14 -5.607618218999999e-15 ] [ 1.23367600818e-14 -4.005441585e-15 -3.845223921599999e-15 ] [ 2.8839179412e-15 5.4474005556e-15 3.78113685624e-14 ] [ -1.77841606374e-14 -1.37787190524e-14 -2.83585264218e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356190887524e-18 } }