{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.526135 0.7707465 2.8703766 ] [ 1.547176 -0.1201576 -0.8098133 ] [ 1.3401831 1.2074779 -0.9167578 ] [ -1.2779458 2.1245704 -1.1045641 ] [ -2.1355482 -3.9826373 -0.0392415 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.429611963846081e-10 1.234872022863427e-09 4.598850281411394e-09 ] [ 2.478849215462861e-09 -1.925136975314381e-10 -1.297463936472897e-09 ] [ 2.147210030411268e-09 1.93459286151268e-09 -1.468807914096042e-09 ] [ -2.047494883409553e-09 3.403937024123705e-09 -1.769706777194993e-09 ] [ -3.421525398631523e-09 -6.380888371186036e-09 -6.28718138651232e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -17.893279 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.866819328325161e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6817223 2.2009412 1.0261179 ] [ 1.1917927 1.7417041 3.2969353 ] [ 0.7389192 3.843874 2.3920269 ] [ 2.5195442 5.3267121 2.0878091 ] [ 2.9810781 3.1277745 2.7309558 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6817223e-10 2.2009412e-10 1.0261179e-10 ] [ 1.1917927e-10 1.7417041e-10 3.2969353e-10 ] [ 7.389192e-11 3.843874e-10 2.3920269e-10 ] [ 2.5195442e-10 5.3267121e-10 2.0878091e-10 ] [ 2.9810781e-10 3.1277745e-10 2.7309558e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.26e-05 2.3e-05 6e-07 ] [ -6.6e-06 3.2e-06 -5.5e-06 ] [ 4.5e-06 -1.98e-05 2.21e-05 ] [ 1.2e-06 1.13e-05 -2.77e-05 ] [ -1.17e-05 -1.77e-05 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.018742542208e-14 3.68500622784e-14 9.6130597248e-16 ] [ -1.057436569728e-14 5.126965186560001e-15 -8.8119714144e-15 ] [ 7.2097947936e-15 -3.172309709184e-14 3.540810331968e-14 ] [ 1.92261194496e-15 1.810459581504e-14 -4.438029239616e-14 ] [ -1.874546646336e-14 -2.835852618816e-14 1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.979559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.040860570289423e-18 } }