{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.9327889 -7.7577957 -14.2802722 ] [ -18.2941179 0.9100291 10.3396172 ] [ 10.6417704 -16.9072415 6.4331842 ] [ 7.8243909 9.0397823 -17.6803334 ] [ 8.7607455 14.7152259 15.1878042 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.431190553412175e-08 -1.242935889948277e-08 -2.287951825750018e-08 ] [ -2.931040799753879e-08 1.458027348267665e-09 1.656589294586156e-08 ] [ 1.704999573880147e-08 -2.708838705351953e-08 1.030709732253995e-08 ] [ 1.253605617198027e-08 1.448332785818165e-08 -2.832701682142937e-08 ] [ 1.403626162087881e-08 2.357639090677064e-08 2.433354481052805e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 96.762036 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.550298718602079e-17 } "relaxed-configuration-positions" { "source-value" [ [ -2.6282166 -2.216806 -3.4664175 ] [ -4.5245009 1.8477023 5.4713656 ] [ 4.2376558 -3.3910544 3.9368779 ] [ 4.2123273 5.0645205 -3.0314002 ] [ 4.3049959 6.3233581 6.8886167 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.6282166e-10 -2.216806e-10 -3.4664175e-10 ] [ -4.5245009e-10 1.8477023e-10 5.4713656e-10 ] [ 4.2376558e-10 -3.3910544e-10 3.9368779e-10 ] [ 4.2123273e-10 5.064520500000001e-10 -3.0314002e-10 ] [ 4.3049959e-10 6.323358100000001e-10 6.8886167e-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" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }