{ "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" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5597023 -20.8035851 6.2899492 ] [ -12.8060953 20.5037892 -3.7417006 ] [ 0.8722447 0.0350514 0.3954218 ] [ -0.1494438 0.4494526 -0.8047165 ] [ 12.0432312 -1.1061931 -0.5530603 ] [ -1.5196392 0.921485 -1.5858936 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.498918581056058e-09 -3.333101795065055e-08 1.007760963728699e-08 ] [ -2.051762666243722e-08 3.285069196470155e-08 -5.99486527274378e-09 ] [ 1.39749007747034e-09 5.61585340689876e-11 6.335355685342211e-10 ] [ -2.394353644561692e-10 7.201024538105483e-10 -1.289297973294261e-09 ] [ 1.929538362649977e-08 -1.772316737512025e-09 -8.8610028985303e-10 ] [ -2.434730418350453e-09 1.47638173558149e-09 -2.540881669930142e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.898194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.585865514559899e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3076952 0.965991 1.1093911 ] [ 0.0729252 3.3407296 0.363377 ] [ 0.2687815 2.890282 2.7068973 ] [ 1.807337 -0.0615045 2.6747654 ] [ 2.2649169 2.3820896 0.4610352 ] [ 2.5335936 2.1451297 2.8209723 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.076952e-11 9.65991e-11 1.1093911e-10 ] [ 7.29252e-12 3.3407296e-10 3.63377e-11 ] [ 2.687815e-11 2.890282e-10 2.7068973e-10 ] [ 1.807337e-10 -6.15045e-12 2.6747654e-10 ] [ 2.2649169e-10 2.3820896e-10 4.610352e-11 ] [ 2.5335936e-10 2.1451297e-10 2.820972300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.69e-05 6.46e-05 2.63e-05 ] [ 1.86e-05 -2.71e-05 1.36e-05 ] [ -1.78e-05 -2.91e-05 -2.93e-05 ] [ -7.3e-06 4.9e-06 -4.6e-06 ] [ -2.96e-05 -5e-06 -1.34e-05 ] [ 9.2e-06 -8.4e-06 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.309855145459999e-14 1.035006105564e-13 4.21372454742e-14 ] [ 2.98004853924e-14 -4.34189867814e-14 2.17896022224e-14 ] [ -2.851874408519999e-14 -4.66233400494e-14 -4.69437753762e-14 ] [ -1.16958894282e-14 7.850665506599998e-15 -7.370012516399999e-15 ] [ -4.74244283664e-14 -8.010883169999999e-15 -2.14691668956e-14 ] [ 1.47400250328e-14 -1.34582837256e-14 1.18561070916e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.74318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.842770840885612e-18 } }