{ "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" [ [ 1.178267 0.166744 1.149708 ] [ 0.7840536 2.31607 1.236295 ] [ 0.8079908 1.595267 2.952936 ] [ 2.817536 1.157767 1.902801 ] [ 1.934708 2.772369 0.0108268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.178267e-10 1.66744e-11 1.149708e-10 ] [ 7.840536e-11 2.31607e-10 1.236295e-10 ] [ 8.079908000000001e-11 1.595267e-10 2.952936e-10 ] [ 2.817536e-10 1.157767e-10 1.902801e-10 ] [ 1.934708e-10 2.772369e-10 1.08268e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4602951 -18.6439526 -7.1518964 ] [ -14.8446246 11.0769903 -2.4136088 ] [ -7.3957608 0.1266286 20.1913193 ] [ 19.1000219 -2.6583749 5.1313045 ] [ 8.6006587 10.0987087 -15.7571186 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.748357151888798e-09 -2.987090497502337e-08 -1.145860120646369e-08 ] [ -2.378371047867255e-08 1.774729488748838e-08 -3.867027591117143e-09 ] [ -1.18493150467891e-08 2.028813824446349e-10 3.235005972556782e-08 ] [ 3.0601608544948e-08 -4.259186114101539e-09 8.221256104105834e-09 ] [ 1.377977429262012e-08 1.617991497940956e-08 -2.524568703209283e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 62.611296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.003143546491886e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.563192 -1.5717114 0.3507824 ] [ -1.5194651 3.7095615 0.8064565 ] [ 0.2589646 1.304638 5.4220313 ] [ 4.9506299 0.9149313 2.5714487 ] [ 3.269234 3.6507975 -1.8981522 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.63192e-11 -1.5717114e-10 3.507824e-11 ] [ -1.5194651e-10 3.7095615e-10 8.064565000000001e-11 ] [ 2.589646e-11 1.304638e-10 5.4220313e-10 ] [ 4.9506299e-10 9.149313000000001e-11 2.5714487e-10 ] [ 3.269234e-10 3.6507975e-10 -1.8981522e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }