{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4008083 0.5190667 2.588988 ] [ 0.3705603 2.591564 0.7446841 ] [ 2.694344 0.0700188 2.876141 ] [ 2.159519 1.331763 1.766469 ] [ 2.561241 2.816208 0.1583109 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.008083e-11 5.190667e-11 2.588988e-10 ] [ 3.705603e-11 2.591564e-10 7.446841e-11 ] [ 2.694344e-10 7.001880000000001e-12 2.876141e-10 ] [ 2.159519e-10 1.331763e-10 1.766469e-10 ] [ 2.561241e-10 2.816208e-10 1.583109e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3097016 -0.3973301 0.5009098 ] [ -1.2237573 -0.5142853 0.632799 ] [ 2.6751906 -4.9929083 4.3217912 ] [ 0.7936117 4.8973151 -4.1764484 ] [ 1.0646566 1.0072086 -1.2790516 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.302726525344353e-09 -6.365929969601261e-10 8.025459706896037e-10 ] [ -1.960675335593332e-09 -8.239758840811141e-10 1.013855763465619e-09 ] [ 4.286127835503925e-09 -7.999520948058272e-09 6.924272820619177e-09 ] [ 1.271506111733343e-09 7.846363757910815e-09 -6.691407984457567e-09 ] [ 1.705767913700417e-09 1.613726071188699e-09 -2.049266570316833e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.124226 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.94251514424955e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4104974 0.7099631 2.5749757 ] [ 0.3958036 2.4426579 0.9345668 ] [ 2.5816146 0.0392518 1.8471222 ] [ 2.2316694 2.3648543 2.5712693 ] [ 2.5668876 1.7718934 0.2066591 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.104974e-11 7.099631e-11 2.5749757e-10 ] [ 3.958036e-11 2.4426579e-10 9.345668e-11 ] [ 2.5816146e-10 3.925180000000001e-12 1.8471222e-10 ] [ 2.2316694e-10 2.3648543e-10 2.5712693e-10 ] [ 2.5668876e-10 1.7718934e-10 2.066591e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.72e-05 5e-06 1.25e-05 ] [ -3.27e-05 -1.23e-05 -2.5e-05 ] [ 3.7e-06 -1.94e-05 -1.81e-05 ] [ 3.19e-05 2.05e-05 3.06e-05 ] [ 1.44e-05 6.3e-06 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.755743787776e-14 8.010883104e-15 2.002720776e-14 ] [ -5.239117550016001e-14 -1.970677243584e-14 -4.005441552e-14 ] [ 5.928053496960001e-15 -3.108222644352e-14 -2.899939683648e-14 ] [ 5.110943420352001e-14 3.28446207264e-14 4.902660459647999e-14 ] [ 2.307134333952e-14 1.009371271104e-14 0.0 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }