{ "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" [ [ 0.7988983 0.4673865 0.2218489 ] [ 0.3258309 0.1815657 2.151485 ] [ 0.290514 2.993692 1.621534 ] [ 2.152844 0.6900228 1.637351 ] [ 2.682916 2.279137 0.4360972 ] [ 1.831466 2.039249 2.911237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.988983e-11 4.673865e-11 2.218489e-11 ] [ 3.258309e-11 1.815657e-11 2.151485e-10 ] [ 2.90514e-11 2.993692e-10 1.621534e-10 ] [ 2.152844e-10 6.900228e-11 1.637351e-10 ] [ 2.682916e-10 2.279137e-10 4.360972e-11 ] [ 1.831466e-10 2.039249e-10 2.911237e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4281503 0.562242 -4.9717039 ] [ -3.4725213 -0.5356673 3.3976581 ] [ -0.1311362 -0.3554144 -0.8474598 ] [ 5.2024103 -3.5427808 1.4107844 ] [ -0.2052359 2.1927364 -1.4661289 ] [ 0.0346334 1.6788841 2.4768501 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.28814904050009e-09 9.008109950534279e-10 -7.965547819746672e-09 ] [ -5.563592487927303e-09 -8.58233631657868e-10 5.443648418140835e-09 ] [ -2.101033555115508e-10 -5.694366470671296e-10 -1.357780289814313e-09 ] [ 8.33518022314093e-09 -5.676160617143827e-09 2.260325801291709e-09 ] [ -3.288241634379606e-10 3.513151024601277e-09 -2.348997466012122e-09 ] [ 5.54888242359756e-11 2.68986887621412e-09 3.968351356140564e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.86359 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221191996135606e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1562757 1.0941554 0.1946164 ] [ 0.6507373 -0.0919666 2.1263404 ] [ 0.7444878 3.123599 1.2901934 ] [ 2.8932351 0.7008295 2.0391042 ] [ 2.3987607 1.8869644 0.1073931 ] [ 1.2389727 1.9374713 3.2219056 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.562757e-11 1.0941554e-10 1.946164e-11 ] [ 6.507373e-11 -9.19666e-12 2.1263404e-10 ] [ 7.444878e-11 3.123599e-10 1.2901934e-10 ] [ 2.8932351e-10 7.008295e-11 2.0391042e-10 ] [ 2.3987607e-10 1.8869644e-10 1.073931e-11 ] [ 1.2389727e-10 1.9374713e-10 3.2219056e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 2.03e-05 1.79e-05 ] [ 3.69e-05 8.8e-06 -1.09e-05 ] [ -8.9e-06 1.38e-05 -2.62e-05 ] [ 5.4e-06 -2.45e-05 1.74e-05 ] [ -9.2e-06 -7.5e-06 7e-07 ] [ -1.42e-05 -1.1e-05 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.61819840034e-14 3.252418567019999e-14 2.86789617486e-14 ] [ 5.91203177946e-14 1.40991543792e-14 -1.74637253106e-14 ] [ -1.42593720426e-14 2.21100375492e-14 -4.197702781079999e-14 ] [ 8.6517538236e-15 -3.925332753299999e-14 2.78778734316e-14 ] [ -1.47400250328e-14 -1.2016324755e-14 1.1215236438e-15 ] [ -2.27509082028e-14 -1.7623942974e-14 1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }