{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0082546 -0.0674937 -0.0333431 ] [ -15.7965308 5.6027128 -12.9490144 ] [ -7.503779 -3.870856 7.891488 ] [ -2.1828456 -8.4812329 0.3110529 ] [ 19.3100686 0.3181213 -1.7009977 ] [ 6.1648323 6.4987484 6.4808144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.322532713405568e-11 -1.08136828191289e-10 -5.342153528499648e-11 ] [ -2.530883233750712e-08 8.976535461216905e-09 -2.074660813408254e-08 ] [ -1.202237928145e-08 -6.201794985683405e-09 1.264355757692375e-08 ] [ -3.497304187136148e-09 -1.358843306793979e-08 4.983616842120403e-10 ] [ 3.093814045696419e-08 5.096865094385031e-10 -2.725298746974573e-09 ] [ 9.877150182212692e-09 1.041214275094141e-08 1.038340931542398e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.504322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.410189538555098e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5281487 0.4647135 -1.3264634 ] [ 0.1170017 2.6428494 0.7986971 ] [ -1.7574705 2.672305 1.9542571 ] [ 3.3071105 0.2677999 4.2661638 ] [ 2.0446043 1.6207444 0.4901653 ] [ 3.200398 1.3411706 2.3495859 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5281487e-10 4.647135e-11 -1.3264634e-10 ] [ 1.170017e-11 2.6428494e-10 7.986971e-11 ] [ -1.7574705e-10 2.672305e-10 1.9542571e-10 ] [ 3.3071105e-10 2.677999e-11 4.2661638e-10 ] [ 2.0446043e-10 1.6207444e-10 4.901653e-11 ] [ 3.200398e-10 1.3411706e-10 2.3495859e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0384815 0.2630494 0.2118352 ] [ -0.5674877 0.1257077 0.1861362 ] [ 0.1853731 0.0817879 -0.1894106 ] [ 0.0980954 -0.0043832 0.1255915 ] [ 0.3528883 -0.4374183 -0.2111009 ] [ -0.0303876 -0.0287434 -0.1230514 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.16541596333152e-11 4.214515987954675e-10 3.393974049024922e-10 ] [ -9.092155255315643e-10 2.014059379945402e-10 2.98223067924553e-10 ] [ 2.970004469452205e-10 1.310386612443283e-10 -3.034692350517005e-10 ] [ 1.571661564880243e-10 -7.022660564290561e-12 2.012197650712032e-10 ] [ 5.653893840138567e-10 -7.008213737700806e-10 -3.382209266098388e-10 ] [ -4.868630228222208e-11 -4.605200348230272e-11 -1.971500762367091e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.920409 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.070077723097391e-18 } }