{ "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" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 20.6536143 16.1913376 -65.4384732 ] [ -20.7395555 -24.3436194 57.4627227 ] [ -14.5581493 0.185388 -62.0864647 ] [ 77.7403645 -19.8496627 47.1017739 ] [ -63.0962741 27.8165565 22.9604412 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.309073823910827e-08 2.594138277592564e-08 -1.048439927256752e-07 ] [ -3.322843122164619e-08 -3.90027781896691e-08 9.206543163596139e-08 ] [ -2.332472664274345e-08 2.97024321823992e-10 -9.947348303000581e-08 ] [ 1.245537955205431e-07 -3.180266577072135e-08 7.546536156253104e-08 ] [ -1.010913760554794e-07 4.456703686264082e-08 3.678668239697092e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 43.173713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.917191417162204e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5585901 1.1787117 0.9742944 ] [ 0.5674448 0.3135137 2.6849167 ] [ 2.7372623 1.790757 0.271879 ] [ 3.1303336 2.9423628 2.3084838 ] [ 1.3595181 2.6379134 3.1015351 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.585901e-11 1.1787117e-10 9.742944e-11 ] [ 5.674448e-11 3.135137e-11 2.6849167e-10 ] [ 2.7372623e-10 1.790757e-10 2.71879e-11 ] [ 3.1303336e-10 2.9423628e-10 2.3084838e-10 ] [ 1.3595181e-10 2.6379134e-10 3.1015351e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.14e-05 0.0001839 -0.0001208 ] [ -0.0001223 -0.0002773 0.0002526 ] [ 7.01e-05 5.14e-05 2.54e-05 ] [ -1.3e-06 3.65e-05 -5.79e-05 ] [ 4.21e-05 5.4e-06 -9.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.82648136276e-14 2.946402829926e-13 -1.935429373872e-13 ] [ -1.959462023381999e-13 -4.442835806082e-13 4.047098177484e-13 ] [ 1.123125820434e-13 8.23518789876e-14 4.06952865036e-14 ] [ -2.0828296242e-15 5.847944714099999e-14 -9.276602710859999e-14 ] [ 6.745163629139998e-14 8.6517538236e-15 -1.592563574196e-13 ] ] } "relaxed-potential-energy" { "source-value" -10.934396 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.751883377810306e-18 } }