{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.444355e-11 1.0001071e-10 2.1814904e-10 ] [ 1.4395794e-10 2.2007486e-10 3.672241e-11 ] [ 2.1700797e-10 2.6588424e-10 2.5559798e-10 ] ] "source-value" [ [ 0.5444355 1.0001071 2.1814904 ] [ 1.4395794 2.2007486 0.3672241 ] [ 2.1700797 2.6588424 2.5559798 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.4142383789248e-13 3.9237305443392e-13 -2.3119408638144e-13 ] [ -2.699667606048e-13 -2.6740327801152e-13 -1.1952237591168e-13 ] [ -7.145707728768e-14 -1.2512999408448e-13 3.507164622931201e-13 ] ] "source-value" [ [ 0.0002131 0.0002449 -0.0001443 ] [ -0.0001685 -0.0001669 -7.46e-05 ] [ -4.46e-05 -7.81e-05 0.0002189 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.106979603914663e-18 "source-value" -6.9092233 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.054133041753572e-09 1.39540259003747e-09 -2.006470670380983e-09 ] [ 1.585167593358263e-09 2.358178078914067e-10 1.00823681790411e-08 ] [ -2.639300635111835e-09 -1.631220397928876e-09 -8.075897508660119e-09 ] ] "source-value" [ [ 0.6579381 0.8709418 -1.2523405 ] [ 0.9893838 0.1471859 6.2929193 ] [ -1.6473219 -1.0181277 -5.0405788 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.60607247233903e-19 "source-value" -5.9956389 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.713336e-11 1.018471e-10 2.25156e-10 ] [ 1.393923e-10 2.191832e-10 9.177125e-12 ] [ 2.188838e-10 2.649395e-10 2.761363e-10 ] ] "source-value" [ [ 0.5713336 1.018471 2.25156 ] [ 1.393923 2.191832 0.09177125 ] [ 2.188838 2.649395 2.761363 ] ] } "instance-id" 1 }