{ "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" [ [ 2.271696 2.59158 0.2830491 ] [ 1.885666 2.994299 3.04756 ] [ 2.618377 0.6246748 1.626494 ] [ 2.195128 4.700519 1.092758 ] [ 3.86025 2.803257 1.694059 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.271696e-10 2.59158e-10 2.830491e-11 ] [ 1.885666e-10 2.994299e-10 3.04756e-10 ] [ 2.618377e-10 6.246748e-11 1.626494e-10 ] [ 2.195128e-10 4.700519e-10 1.092758e-10 ] [ 3.86025e-10 2.803257e-10 1.694059e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1439195 -1.3723787 -1.838257 ] [ 1.8475393 -1.992127 -3.7870494 ] [ -0.5436679 4.0745696 1.6340065 ] [ 0.5587074 -1.1996682 1.8871108 ] [ 0.2813406 0.4896043 2.1041892 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.434937728076963e-09 -2.198793086139296e-09 -2.945212412686938e-09 ] [ 2.960084296856716e-09 -3.191739331360518e-09 -6.067522060483719e-09 ] [ -8.710520060358485e-10 6.528180206726726e-09 2.61796703410412e-09 ] [ 8.951479415228914e-10 -1.922080358592839e-09 3.023484829529047e-09 ] [ 4.507573355155403e-10 7.844325693659261e-10 3.371282769755152e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.607295 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.981217327094503e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0171755 2.5271507 0.316442 ] [ 1.7615254 2.8293235 2.6495295 ] [ 2.7214927 0.8497461 1.8109872 ] [ 2.410954 4.635986 1.2865808 ] [ 3.9199694 2.8721233 1.6803805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0171755e-10 2.5271507e-10 3.16442e-11 ] [ 1.7615254e-10 2.8293235e-10 2.6495295e-10 ] [ 2.7214927e-10 8.497461e-11 1.8109872e-10 ] [ 2.410954e-10 4.635986e-10 1.2865808e-10 ] [ 3.9199694e-10 2.8721233e-10 1.6803805e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 8.1e-06 1.99e-05 ] [ 1.72e-05 -3e-06 -2.4e-05 ] [ -2.2e-06 -1.8e-06 3e-06 ] [ 1.2e-06 -7.4e-06 4e-07 ] [ -2.08e-05 4.1e-06 7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.209794853e-15 1.29776307354e-14 3.18833150166e-14 ] [ 2.75574381048e-14 -4.806529901999999e-15 -3.8452239216e-14 ] [ -3.5247885948e-15 -2.8839179412e-15 4.806529901999999e-15 ] [ 1.9226119608e-15 -1.18561070916e-14 6.408706536e-16 ] [ -3.332527398719999e-14 6.568924199399999e-15 1.1215236438e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245508681305e-18 } }