{ "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" [ [ 2.146483 1.678803 1.689789 ] [ 0.9939717 3.024801 3.865516 ] [ 2.198915 3.863733 1.927968 ] [ 4.22715 2.33689 1.172014 ] [ 3.633184 2.755923 3.714191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146483e-10 1.678803e-10 1.689789e-10 ] [ 9.939717000000001e-11 3.024801e-10 3.865516e-10 ] [ 2.198915e-10 3.863733e-10 1.927968e-10 ] [ 4.22715e-10 2.33689e-10 1.172014e-10 ] [ 3.633184e-10 2.755923e-10 3.714191e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1769929 0.0070596 -0.9549998 ] [ 2.4917104 1.796843 -3.9973606 ] [ -2.9822468 -0.4408349 4.3433148 ] [ -2.6864565 -1.3630676 0.6090456 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.090103748827593e-09 1.131072607219968e-11 -1.530078352428676e-09 ] [ 3.992160148684217e-09 2.878859845848134e-09 -6.404477698227061e-09 ] [ -4.778086100415614e-09 -7.062953704127059e-10 6.958757429334627e-09 ] [ -4.304177797096194e-09 -2.183875041289966e-09 9.757986213211085e-10 ] [ 0.0 0.0 0.0 ] ] } "unrelaxed-potential-energy" { "source-value" -4.5062026 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.219732454308174e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7276203 2.3544614 1.0872484 ] [ 0.1421694 3.765325 3.6367842 ] [ 2.1555257 3.0386871 3.1013125 ] [ 4.4181811 1.541448 -0.0687253 ] [ 3.7562071 2.9602284 4.6128582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7276203e-10 2.3544614e-10 1.0872484e-10 ] [ 1.421694e-11 3.765325e-10 3.6367842e-10 ] [ 2.1555257e-10 3.038687100000001e-10 3.1013125e-10 ] [ 4.4181811e-10 1.541448e-10 -6.87253e-12 ] [ 3.756207100000001e-10 2.9602284e-10 4.6128582e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.5693476 -0.3221121 -0.5722595 ] [ 0.227875 -0.0940133 -0.104873 ] [ -0.5878278 0.2470446 0.2802281 ] [ -0.414625 0.1587114 0.1221075 ] [ 0.2052302 0.0103694 0.2747969 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.1219541382859e-10 -5.160804758967918e-10 -9.168607919306976e-10 ] [ 3.650959974648e-10 -1.506259113042566e-10 -1.680250687531584e-10 ] [ -9.418039582162984e-10 3.958090824148877e-10 4.489749103112045e-10 ] [ -6.643024813992001e-10 2.542836945344371e-10 1.95637781724336e-10 ] [ 3.288150283221082e-10 1.661361025172352e-11 4.402731686483155e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.21338 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.636363865534631e-18 } }