{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2683828 -2.5805191 -0.4034357 ] [ -2.0522303 -0.1617041 0.6143071 ] [ 1.0858245 3.0335425 0.1987194 ] [ -0.0003329 2.9843991 -3.3652671 ] [ 4.2351215 -3.2757184 2.9556762 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.236526509984842e-09 -4.134447371547858e-09 -6.463752465360826e-10 ] [ -3.288035407157371e-09 -2.590785285075053e-10 9.842284736114476e-10 ] [ 1.73968262819185e-09 4.860270871703184e-09 3.183835767794035e-10 ] [ -5.333645970643199e-13 4.781534465156561e-09 -5.391752270367416e-09 ] [ 6.785412653547427e-09 -5.248279436804384e-09 4.735515306294985e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5172639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.364616109376383e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4089317 2.5782027 1.5420122 ] [ 1.9087922 4.410804 3.0985171 ] [ 4.1168836 5.3555406 2.5855993 ] [ 3.808214 4.304342 0.2732246 ] [ 4.8494835 2.9304787 2.225383 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4089317e-10 2.5782027e-10 1.5420122e-10 ] [ 1.9087922e-10 4.410804e-10 3.0985171e-10 ] [ 4.1168836e-10 5.355540600000001e-10 2.5855993e-10 ] [ 3.808214e-10 4.304342e-10 2.732246e-11 ] [ 4.8494835e-10 2.9304787e-10 2.225383e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.4e-06 -9.1e-06 8.8e-06 ] [ -1.22e-05 2.17e-05 3.8e-06 ] [ -1.25e-05 -5.7e-06 1.15e-05 ] [ 1.2e-06 1.03e-05 -2e-05 ] [ 1.91e-05 -1.73e-05 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.04957713152e-15 -1.457980724928e-14 1.409915426304e-14 ] [ -1.954655477376e-14 3.476723267136e-14 6.08827115904e-15 ] [ -2.002720776e-14 -9.13240673856e-15 1.84250311392e-14 ] [ 1.92261194496e-15 1.650241919424e-14 -3.2043532416e-14 ] [ 3.060157345728e-14 -2.771765553984e-14 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.977047 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758716806882278e-18 } }