{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.5650552 -6.5914044 -13.1132188 ] [ -4.0734449 11.1546527 -0.8945859 ] [ -2.2745872 -5.6319857 11.4352682 ] [ -12.0688771 2.4471833 -1.1394406 ] [ 2.8253644 4.4748836 1.7771086 ] [ 2.7623618 -0.1838677 10.9452693 ] [ 8.2641279 -5.6694619 -9.0104008 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.314024774360195e-09 -1.056059411492479e-08 -2.100969275788952e-08 ] [ -6.526378238666467e-09 1.787172391632501e-08 -1.433284626085861e-09 ] [ -3.644290463835485e-09 -9.023435891562133e-09 1.832131951356324e-08 ] [ -1.933647288823768e-08 3.920819902375011e-09 -1.82558510515094e-09 ] [ 4.52673282421543e-09 7.169553943789803e-09 2.847241875000452e-09 ] [ 4.42579153061418e-09 -2.945885326873218e-10 1.753625472529753e-08 ] [ 1.324059262176749e-08 -9.083479383533244e-09 -1.44362536247349e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -18.466814 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.958709789522407e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6811105 1.9358914 1.2504663 ] [ 0.4349315 2.9082822 2.1073257 ] [ 1.7280561 1.3094469 3.5098397 ] [ 2.4519745 4.3579826 1.9479512 ] [ 4.1947088 1.0684038 3.0695913 ] [ 4.713277 3.2521824 1.9507538 ] [ 3.2454415 3.2224797 4.023226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6811105e-10 1.9358914e-10 1.2504663e-10 ] [ 4.349315000000001e-11 2.9082822e-10 2.1073257e-10 ] [ 1.7280561e-10 1.3094469e-10 3.5098397e-10 ] [ 2.4519745e-10 4.3579826e-10 1.9479512e-10 ] [ 4.1947088e-10 1.0684038e-10 3.0695913e-10 ] [ 4.713277e-10 3.2521824e-10 1.9507538e-10 ] [ 3.2454415e-10 3.2224797e-10 4.023226e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.83e-05 -1.92e-05 -2.44e-05 ] [ 3.1e-06 6.9e-06 -1e-07 ] [ 2.8e-06 -6.4e-06 -9e-07 ] [ -2.27e-05 4.2e-06 -3e-06 ] [ -5.1e-06 -2.6e-06 2.2e-06 ] [ 4.82e-05 5.9e-06 -1.66e-05 ] [ -7.9e-06 1.11e-05 4.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.93198324022e-14 -3.076179137279999e-14 -3.909310986959999e-14 ] [ 4.9667475654e-15 1.10550187746e-14 -1.602176634e-16 ] [ 4.486094575199999e-15 -1.02539304576e-14 -1.4419589706e-15 ] [ -3.636940959179999e-14 6.729141862799999e-15 -4.806529901999999e-15 ] [ -8.1711008334e-15 -4.165659248399999e-15 3.5247885948e-15 ] [ 7.72249137588e-14 9.452842140600001e-15 -2.65961321244e-14 ] [ -1.26571954086e-14 1.77841606374e-14 6.873337759859999e-14 ] ] } "relaxed-potential-energy" { "source-value" -27.211343 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.359737793435946e-18 } }