{ "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" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.8521377 -10.0937626 -2.6769173 ] [ -7.6350465 3.4051774 8.759426 ] [ -6.9043108 2.9490087 -2.6033961 ] [ 6.0162199 -4.4323925 -3.964 ] [ 7.7208848 -5.3206946 6.3359358 ] [ 1.9073113 0.7695712 -10.253287 ] [ 6.747079 12.7230924 4.4022387 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.258051144624228e-08 -1.617199045362542e-08 -4.28889431387506e-09 ] [ -1.223269300102087e-08 5.45569561995653e-09 1.403414754882766e-08 ] [ -1.106192534649695e-08 4.724832793675801e-09 -4.171100366101899e-09 ] [ 9.639046869371715e-09 -7.101475637709264e-09 -6.351028124851201e-09 ] [ 1.237022111845009e-08 -8.524692494536808e-09 1.015128820964974e-08 ] [ 3.055849573447655e-09 1.232988984681001e-09 -1.642757671775257e-08 ] [ 1.081001223249064e-08 2.038464118755816e-08 7.053163924320985e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.437417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.633564522374047e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2634198 1.6306886 2.5393001 ] [ 1.9605969 3.2555754 4.5946358 ] [ 1.4547791 4.1278265 2.2808879 ] [ 4.8469329 1.8644483 2.0626388 ] [ 4.0570609 1.8567328 4.4597496 ] [ 3.2386362 3.2680586 0.7160282 ] [ 3.9597792 4.1183748 3.1062746 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2634198e-10 1.6306886e-10 2.5393001e-10 ] [ 1.9605969e-10 3.2555754e-10 4.5946358e-10 ] [ 1.4547791e-10 4.127826500000001e-10 2.2808879e-10 ] [ 4.8469329e-10 1.8644483e-10 2.0626388e-10 ] [ 4.0570609e-10 1.8567328e-10 4.4597496e-10 ] [ 3.238636200000001e-10 3.2680586e-10 7.160282e-11 ] [ 3.9597792e-10 4.1183748e-10 3.1062746e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.42e-05 1.43e-05 9.7e-06 ] [ 2.69e-05 -3.4e-06 -1.77e-05 ] [ 6.04e-05 -3.06e-05 -7.4e-06 ] [ -4.4e-05 3.76e-05 2.46e-05 ] [ -2.11e-05 3.23e-05 -2.22e-05 ] [ -1.92e-05 2.15e-05 2.43e-05 ] [ -2.73e-05 -7.17e-05 -1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.877267422336e-14 2.291112567744e-14 1.554111322176e-14 ] [ 4.309855109952001e-14 -5.44740051072e-15 -2.835852618816e-14 ] [ 9.677146789632e-14 -4.902660459647999e-14 -1.185610699392e-14 ] [ -7.04957713152e-14 6.024184094208e-14 3.941354487168e-14 ] [ -3.380592669888e-14 5.175030485184e-14 -3.556832098176e-14 ] [ -3.076179111936e-14 3.44467973472e-14 3.893289188544e-14 ] [ -4.373942174784e-14 -1.1487606371136e-13 -1.810459581504e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.454184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917992188554143e-18 } }