{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.5728803 -27.7342492 -12.0332844 ] [ -14.0544468 -5.2930342 -26.5200414 ] [ -46.1847261 42.9836394 15.6137059 ] [ 84.7316149 -56.7874445 33.8753849 ] [ 1.6423954 1.7171704 -5.3776583 ] [ -9.5619571 45.1139182 -5.5581067 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.655268157473891e-08 -4.443516602977319e-08 -1.927944709595671e-08 ] [ -2.251770626675607e-08 -8.480375718202883e-09 -4.248979066379265e-08 ] [ -7.399608900510994e-08 6.886738269096178e-08 2.501591476312793e-08 ] [ 1.357550135538662e-07 -9.09835166824718e-08 5.427435015453642e-08 ] [ 2.631407533669083e-09 2.751210291476433e-09 -8.615958473896161e-09 ] [ -1.53199442409304e-08 7.228046560822734e-08 -8.905068684018847e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 42.741803 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.847991806163109e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.391439 0.1650016 1.5698785 ] [ 0.3297778 2.1842397 0.5773983 ] [ -0.2973762 3.7012628 2.3009674 ] [ 3.5874346 0.7927163 2.4961171 ] [ 2.8078061 1.9839133 0.4842598 ] [ 1.6976877 2.4172529 2.7524772 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.391439e-10 1.650016e-11 1.5698785e-10 ] [ 3.297778e-11 2.1842397e-10 5.773983e-11 ] [ -2.973762e-11 3.7012628e-10 2.3009674e-10 ] [ 3.5874346e-10 7.927163000000001e-11 2.4961171e-10 ] [ 2.8078061e-10 1.9839133e-10 4.842598e-11 ] [ 1.6976877e-10 2.4172529e-10 2.7524772e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.8e-06 3e-06 -4.4e-05 ] [ -3.37e-05 -6.5e-06 3e-05 ] [ 2.01e-05 -6e-07 -1.4e-06 ] [ 2.5e-05 -1.2e-06 3.88e-05 ] [ 2.17e-05 -1.32e-05 -3.19e-05 ] [ -2.93e-05 1.85e-05 8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.088271209199999e-15 4.806529901999999e-15 -7.049577189599999e-14 ] [ -5.399335256579999e-14 -1.0414148121e-14 4.806529901999999e-14 ] [ 3.22037503434e-14 -9.613059803999998e-16 -2.2430472876e-15 ] [ 4.005441585e-14 -1.9226119608e-15 6.21644533992e-14 ] [ 3.476723295779999e-14 -2.11487315688e-14 -5.11094346246e-14 ] [ -4.69437753762e-14 2.9640267729e-14 1.3618501389e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.61623 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.822431208516982e-18 } }