{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.596447 0.5894877 3.838334 ] [ 1.369077 2.86119 3.866131 ] [ 2.011058 5.105046 2.796353 ] [ 3.116098 2.834339 2.386368 ] [ 3.638135 2.33604 4.892399 ] [ 3.921466 4.7829 1.89112 ] [ 5.122204 3.316972 3.335617 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.596447e-10 5.894877e-11 3.838334e-10 ] [ 1.369077e-10 2.86119e-10 3.866131e-10 ] [ 2.011058e-10 5.105046e-10 2.796353e-10 ] [ 3.116098e-10 2.834339e-10 2.386368e-10 ] [ 3.638135e-10 2.33604e-10 4.892399e-10 ] [ 3.921466e-10 4.7829e-10 1.89112e-10 ] [ 5.122204e-10 3.316972e-10 3.335617e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1656718 -4.1299468 -1.8569259 ] [ -4.5545342 1.3882995 3.1824098 ] [ -10.3835414 3.6086253 5.2783417 ] [ -5.8327109 -14.2514255 -7.1507435 ] [ 1.3892126 3.2607035 4.5962996 ] [ 12.1540365 9.8161422 -7.4052478 ] [ 8.3932093 0.3076018 3.355866 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.867612105485853e-09 -6.616904208107774e-09 -2.975123263537999e-09 ] [ -7.297168213874031e-09 2.22430100156833e-09 5.098782579364803e-09 ] [ -1.66362672721889e-08 5.781655088887386e-09 8.45683566833373e-09 ] [ -9.345033039865327e-09 -2.283330074917295e-08 -1.145675405703756e-08 ] [ 2.225763949040782e-09 5.224222915060733e-09 7.364083761312391e-09 ] [ 1.947291312864986e-08 1.572719353928828e-08 -1.186451489639064e-08 ] [ 1.344740371394113e-08 4.928324124759974e-10 5.376690047737613e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.645211 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.705550818768299e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.3196873 1.1744146 3.4902496 ] [ 1.2070195 2.7652204 3.6249801 ] [ 2.4087836 4.9943965 3.724807 ] [ 2.4801329 2.4355136 1.4584454 ] [ 3.2643925 3.1563065 5.2455886 ] [ 3.9579456 4.359676 1.9113441 ] [ 5.1365235 2.9404471 3.5509073 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3196873e-10 1.1744146e-10 3.4902496e-10 ] [ 1.2070195e-10 2.7652204e-10 3.6249801e-10 ] [ 2.4087836e-10 4.9943965e-10 3.724807000000001e-10 ] [ 2.4801329e-10 2.4355136e-10 1.4584454e-10 ] [ 3.2643925e-10 3.1563065e-10 5.2455886e-10 ] [ 3.9579456e-10 4.359676000000001e-10 1.9113441e-10 ] [ 5.1365235e-10 2.9404471e-10 3.5509073e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.78e-05 5.25e-05 -9.2e-06 ] [ 3.73e-05 -1.58e-05 1.8e-06 ] [ -2.02e-05 4.74e-05 9.3e-06 ] [ 8.57e-05 -3.1e-06 1.31e-05 ] [ 1.99e-05 -2.99e-05 4.85e-05 ] [ -2.73e-05 -1.8e-05 -3.5e-05 ] [ -6.76e-05 -3.29e-05 -2.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.454051005824e-14 8.4114272592e-14 -1.474002491136e-14 ] [ 5.976118795584e-14 -2.531439060864e-14 2.88391791744e-15 ] [ -3.236396774016e-14 7.594317182591999e-14 1.490024257344e-14 ] [ 1.3730653640256e-13 -4.96674752448e-15 2.098851373248e-14 ] [ 3.188331475392e-14 -4.790508096192e-14 7.77055661088e-14 ] [ -4.373942174784e-14 -2.88391791744e-14 -5.6076181728e-14 ] [ -1.0830713956608e-13 -5.271161082432e-14 -4.550181603071999e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }