{ "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" [ [ -4.5570816 0.7304435 -0.4451973 ] [ -1.4637744 -2.3522936 2.2947735 ] [ 6.776142 -15.4796779 13.5328865 ] [ -2.1476466 15.2794099 -13.1722061 ] [ 1.3923605 1.8221181 -2.2102565 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.301249598597858e-09 1.170299498515325e-09 -7.132847057032839e-10 ] [ -2.345225121805547e-09 -3.768789811177467e-09 3.676632451731389e-09 ] [ 1.085657629162095e-08 -2.480117802889444e-08 2.168207436223994e-08 ] [ -3.440909172260609e-09 2.448031332140007e-08 -2.110420065777915e-08 ] [ 2.230807440825398e-09 2.919355020156517e-09 -3.541221290271235e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.977049 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.758717127317602e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4389996 0.7190102 2.5450413 ] [ 0.4304991 2.4209713 0.9432832 ] [ 2.5913111 0.1004679 1.8762022 ] [ 2.1427843 2.2856288 2.4955041 ] [ 2.5828786 1.8025423 0.2745622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.389996e-11 7.190102000000001e-11 2.5450413e-10 ] [ 4.304991e-11 2.4209713e-10 9.432832e-11 ] [ 2.5913111e-10 1.004679e-11 1.8762022e-10 ] [ 2.1427843e-10 2.2856288e-10 2.4955041e-10 ] [ 2.5828786e-10 1.8025423e-10 2.745622e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.14e-05 -2.93e-05 -3.07e-05 ] [ -1.62e-05 3.89e-05 -1.21e-05 ] [ 6.9e-06 1.62e-05 2.64e-05 ] [ 2.86e-05 -8e-07 5.9e-06 ] [ -3.07e-05 -2.5e-05 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.826481347712e-14 -4.694377498944e-14 -4.918682225856e-14 ] [ -2.595526125696e-14 6.232467054911999e-14 -1.938633711168e-14 ] [ 1.105501868352e-14 2.595526125696e-14 4.229746278912e-14 ] [ 4.582225135488e-14 -1.28174129664e-15 9.45284206272e-15 ] [ -4.918682225856e-14 -4.005441552e-14 1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.132621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.225601468162712e-18 } }