{ "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" [ [ 2.498918560467988e-09 -3.333101767604323e-08 1.007760955425966e-08 ] [ -2.051762649339677e-08 3.285069169405154e-08 -5.994865223353333e-09 ] [ 1.39749006595671e-09 5.615853360630913e-11 6.335355633146535e-10 ] [ -2.39435362483511e-10 7.20102447877774e-10 -1.289297962672003e-09 ] [ 1.929538346752913e-08 -1.772316722910277e-09 -8.861002825526342e-10 ] [ -2.434730398291215e-09 1.476381723417888e-09 -2.540881648996347e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.898194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.585865501494284e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3077696 0.9659746 1.1093081 ] [ 0.0728874 3.3407266 0.3634173 ] [ 0.268812 2.8901942 2.7069081 ] [ 1.8072023 -0.0614744 2.6749094 ] [ 2.264925 2.3821832 0.4609881 ] [ 2.533653 2.1451131 2.8209074 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.077696e-11 9.659746e-11 1.1093081e-10 ] [ 7.288740000000001e-12 3.3407266e-10 3.634173e-11 ] [ 2.68812e-11 2.8901942e-10 2.7069081e-10 ] [ 1.8072023e-10 -6.14744e-12 2.6749094e-10 ] [ 2.264925e-10 2.3821832e-10 4.609881000000001e-11 ] [ 2.533653e-10 2.1451131e-10 2.8209074e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 3.1e-06 3.32e-05 ] [ -1.3e-05 7.08e-05 -4.78e-05 ] [ -9.21e-05 3.3e-06 6.37e-05 ] [ 5.38e-05 2.21e-05 -3.1e-05 ] [ 4.68e-05 -8.02e-05 -5.54e-05 ] [ 1.19e-05 -1.91e-05 3.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.169588933184e-14 4.96674752448e-15 5.319226381056e-14 ] [ -2.08282960704e-14 1.1343410475264e-13 -7.658404247424001e-14 ] [ -1.4756046677568e-13 5.28718284864e-15 1.0205865074496e-13 ] [ 8.619710219904001e-14 3.540810331968e-14 -4.96674752448e-14 ] [ 7.498186585344001e-14 -1.2849456498816e-13 -8.876058479231999e-14 ] [ 1.906590178752e-14 -3.060157345728e-14 5.976118795584e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.74318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.842770817464615e-18 } }