{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.302275 0.3737398 2.647818 ] [ 0.2826825 1.480501 1.727575 ] [ 0.6414777 2.53008 2.452953 ] [ 2.763361 0.4669357 0.177905 ] [ 2.062003 2.101671 0.3497139 ] [ 2.601995 2.989286 1.853157 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.302275e-10 3.737398e-11 2.647818e-10 ] [ 2.826825e-11 1.480501e-10 1.727575e-10 ] [ 6.414777000000001e-11 2.53008e-10 2.452953e-10 ] [ 2.763361e-10 4.669357e-11 1.77905e-11 ] [ 2.062003e-10 2.101671e-10 3.497139e-11 ] [ 2.601995e-10 2.989286e-10 1.853157e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 16.0766368 -27.0924781 17.9266837 ] [ -52.5316945 -85.9347539 -86.6045734 ] [ 19.6547051 109.8083056 81.2273668 ] [ 15.4681386 -35.9628386 -8.1792757 ] [ -17.4273956 16.2981689 -26.7661505 ] [ 18.7596097 22.8835962 22.3959491 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.575761162205293e-08 -4.340693501135601e-08 2.872171351261644e-08 ] [ -8.416505277890794e-08 -1.376826536127816e-07 -1.387558227558376e-07 ] [ 3.149030899993853e-08 1.759323000019817e-07 1.301405880561061e-07 ] [ 2.478269003221404e-08 -5.76188192225238e-08 -1.310464430161755e-08 ] [ -2.792176579175279e-08 2.611254517342966e-08 -4.288410055991423e-08 ] [ 3.00562080766729e-08 3.666356283146772e-08 3.58822660486468e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 58.033907 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.298056900908147e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2503256 0.0282073 2.4854457 ] [ -0.2703926 1.568509 1.1534043 ] [ 0.9974775 2.4638675 3.165938 ] [ 3.149984 0.6352226 1.0186289 ] [ 1.6292642 2.1755233 -0.3134146 ] [ 2.8971355 3.0708838 1.6991196 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2503256e-10 2.82073e-12 2.4854457e-10 ] [ -2.703926e-11 1.568509e-10 1.1534043e-10 ] [ 9.974775000000001e-11 2.4638675e-10 3.165938e-10 ] [ 3.149984e-10 6.352226e-11 1.0186289e-10 ] [ 1.6292642e-10 2.1755233e-10 -3.134146e-11 ] [ 2.8971355e-10 3.0708838e-10 1.6991196e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-06 -4.8e-06 -3.1e-06 ] [ -1.21e-05 1e-07 9.6e-06 ] [ -2.6e-06 7.3e-06 -1.18e-05 ] [ 3.2e-06 6.2e-06 -1.23e-05 ] [ 2.31e-05 -3e-07 3.24e-05 ] [ -1.01e-05 -8.5e-06 -1.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4032649312e-15 -7.69044777984e-15 -4.96674752448e-15 ] [ -1.938633711168e-14 1.6021766208e-16 1.538089555968e-14 ] [ -4.16565921408e-15 1.169588933184e-14 -1.890568412544e-14 ] [ 5.126965186560001e-15 9.93349504896e-15 -1.970677243584e-14 ] [ 3.701027994048e-14 -4.8065298624e-16 5.191052251392001e-14 ] [ -1.618198387008e-14 -1.36185012768e-14 -2.355199632576e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471878550046e-18 } }