{ "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" [ [ 1.054063 0.143936 1.020128 ] [ 0.3465957 1.342343 2.730037 ] [ 0.4577023 2.369538 0.7306134 ] [ 2.27069 2.392327 1.674561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.054063e-10 1.43936e-11 1.020128e-10 ] [ 3.465957e-11 1.342343e-10 2.730037e-10 ] [ 4.577023e-11 2.369538e-10 7.306134e-11 ] [ 2.27069e-10 2.392327e-10 1.674561e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4751551 -5.3704265 -2.2315569 ] [ -2.6769844 -0.9588278 5.7482091 ] [ -4.1226672 3.6085591 -5.0194801 ] [ 6.3244965 2.7206952 1.502828 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.612823924738862e-10 -8.604371782024771e-09 -3.575348293164924e-09 ] [ -4.289001819926315e-09 -1.536211484533098e-09 9.20964623148981e-09 ] [ -6.605241003178999e-09 5.781549024795089e-09 -8.042093664790846e-09 ] [ 1.013296043063143e-08 4.35903424176278e-09 2.407795886683622e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.619717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.799425951312314e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2856551 0.2481004 1.0076628 ] [ 1.0901791 0.9338802 3.0112681 ] [ 0.9743464 2.1901917 0.0664016 ] [ 1.7788704 2.8759716 2.0700069 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.856551e-11 2.481004e-11 1.0076628e-10 ] [ 1.0901791e-10 9.338802000000001e-11 3.0112681e-10 ] [ 9.743464e-11 2.1901917e-10 6.640160000000001e-12 ] [ 1.7788704e-10 2.8759716e-10 2.0700069e-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 ] ] "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 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }