{ "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" [ [ 0.7742052 0.6824645 0.5764372 ] [ 0.6127639 2.971614 0.4436307 ] [ 0.405499 2.567939 2.589337 ] [ 2.552542 1.167694 2.901906 ] [ 2.397264 1.657583 0.5767519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.742052e-11 6.824645e-11 5.764372e-11 ] [ 6.127639e-11 2.971614e-10 4.436307e-11 ] [ 4.05499e-11 2.567939e-10 2.589337e-10 ] [ 2.552542e-10 1.167694e-10 2.901906e-10 ] [ 2.397264e-10 1.657583e-10 5.767519e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.6009552 -24.3555971 -4.5633791 ] [ -11.6426882 24.630619 -5.1785659 ] [ 0.6806602 2.1532845 8.8331088 ] [ -1.5231548 1.5467378 2.0972785 ] [ 18.0861379 -3.9750442 -1.1884422 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.973719475588188e-09 -3.902196825924428e-08 -7.311339305867345e-09 ] [ -1.865364283730404e-08 3.946260191763227e-08 -8.296977214252111e-09 ] [ 1.090537859149052e-09 3.449942083831017e-09 1.415220040834274e-08 ] [ -2.4403630104193e-09 2.478147141667627e-09 3.360210580006493e-09 ] [ 2.897718730394481e-08 -6.36872288388664e-09 -1.904094308012118e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.734578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.187806801754022e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5889338 0.551709 -0.3831651 ] [ 0.3411946 2.6915088 0.7023464 ] [ 0.6103867 2.8680469 3.0137168 ] [ 2.6038748 1.6368567 3.0321108 ] [ 2.5978843 1.2991731 0.7230539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.889338e-11 5.51709e-11 -3.831651e-11 ] [ 3.411946000000001e-11 2.6915088e-10 7.023464e-11 ] [ 6.103867e-11 2.8680469e-10 3.0137168e-10 ] [ 2.6038748e-10 1.6368567e-10 3.0321108e-10 ] [ 2.5978843e-10 1.2991731e-10 7.230539000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.12e-05 -7.94e-05 3.9e-06 ] [ -5.42e-05 0.0001541 1.81e-05 ] [ 5.8e-06 -8.81e-05 -7.13e-05 ] [ -3e-07 1.2e-06 -7.38e-05 ] [ 0.00012 1.22e-05 0.0001231 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.1407497540096e-13 -1.2721282369152e-13 6.24848882112e-15 ] [ -8.683797284736e-14 2.4689541726528e-13 2.899939683648e-14 ] [ 9.292624400640001e-15 -1.4115176029248e-13 -1.1423519306304e-13 ] [ -4.8065298624e-16 1.92261194496e-15 -1.1824063461504e-13 ] [ 1.92261194496e-13 1.954655477376e-14 1.9722794202048e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.456761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.476446110749323e-18 } }