{ "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" [ [ -3.434937699777226e-09 -2.198793068023897e-09 -2.945212388421945e-09 ] [ 2.960084272469198e-09 -3.191739305064442e-09 -6.067522010494668e-09 ] [ -8.710519988594322e-10 6.528180152942409e-09 2.617967012535235e-09 ] [ 8.951479341479539e-10 -1.922080342757219e-09 3.023484804619184e-09 ] [ 4.507573318018445e-10 7.844325629031495e-10 3.371282741979855e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.607295 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.981217302532874e-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" [ [ 7.2097947936e-15 1.297763062848e-14 3.188331475392e-14 ] [ 2.755743787776e-14 -4.8065298624e-15 -3.84522388992e-14 ] [ -3.52478856576e-15 -2.88391791744e-15 4.8065298624e-15 ] [ 1.92261194496e-15 -1.185610699392e-14 6.408706483200001e-16 ] [ -3.332527371264e-14 6.568924145279999e-15 1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }