{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.438828 2.90963 1.106787 ] [ 1.47463 4.835343 1.863436 ] [ 2.314132 3.251036 2.795551 ] [ 3.696872 4.248886 0.9164855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.38828e-11 2.90963e-10 1.106787e-10 ] [ 1.47463e-10 4.835343e-10 1.863436e-10 ] [ 2.314132e-10 3.251036e-10 2.795551e-10 ] [ 3.696872e-10 4.248886e-10 9.164855e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5551357 -0.3463447 0.7635771 ] [ -2.8613981 7.8543403 -4.7562902 ] [ 3.9050574 -7.2375294 2.421251 ] [ -1.598795 -0.2704663 1.5714621 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.894254399114426e-10 -5.549053810779898e-10 1.223385377798264e-09 ] [ -4.584465138621541e-09 1.258404040046726e-08 -7.620416960180156e-09 ] [ 6.256591669162034e-09 -1.159580039703265e-08 3.87927174528862e-09 ] [ -2.561551970451936e-09 -4.33334782574279e-10 2.517759837093272e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.5532392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.37037998783501e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.206507 2.9375847 1.5826394 ] [ 1.4760287 4.922224 1.3372149 ] [ 2.4331501 2.8722929 2.3879354 ] [ 3.8087762 4.5127934 1.3744699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06507e-11 2.9375847e-10 1.5826394e-10 ] [ 1.4760287e-10 4.922224e-10 1.3372149e-10 ] [ 2.4331501e-10 2.8722929e-10 2.3879354e-10 ] [ 3.8087762e-10 4.5127934e-10 1.3744699e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.63e-05 -1.29e-05 -2.77e-05 ] [ 3.27e-05 5.8e-06 1.73e-05 ] [ 7.4e-06 -1.85e-05 4.41e-05 ] [ -3.7e-06 2.57e-05 -3.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.815901133504e-14 -2.066807840832e-14 -4.438029239616e-14 ] [ 5.239117550016001e-14 9.292624400640001e-15 2.771765553984e-14 ] [ 1.185610699392e-14 -2.96402674848e-14 7.065598897728e-14 ] [ -5.928053496960001e-15 4.117593915456e-14 -5.415356978304e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.280975 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.647193778402928e-18 } }