{ "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" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6198131 -8.5060519 -4.6263596 ] [ -5.0879598 -3.930437 5.5163729 ] [ -2.0593799 4.3905011 -4.5163009 ] [ -2.7503006 5.8738534 1.6126381 ] [ 9.3570963 -3.1842382 2.6891998 ] [ 3.4336275 2.8968345 -2.8623436 ] [ 1.7267296 2.4595379 2.1867933 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.401756541285572e-09 -1.362819748949142e-08 -7.41224519053364e-09 ] [ -8.151810239130244e-09 -6.29725427092729e-09 8.838203691994696e-09 ] [ -3.299490329125442e-09 7.034358216016683e-09 -7.235911714477999e-09 ] [ -4.406467321492213e-09 9.410950591486589e-09 2.583731061631333e-09 ] [ 1.499172093043418e-08 -5.101711999098274e-09 4.308573048220036e-09 ] [ 5.501277705035952e-09 4.641240510226858e-09 -4.585979996616507e-09 ] [ 2.766525795563336e-09 3.940614121351528e-09 3.503629099782081e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6491674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.448787314465522e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7260496 1.7010213 1.9725152 ] [ 1.9146789 2.0232509 4.2404275 ] [ 2.5626136 3.9651636 0.9806404 ] [ 2.4276679 5.2603383 2.996449 ] [ 5.0098288 2.5919674 2.8615227 ] [ 4.9916768 4.0630854 0.9273448 ] [ 3.5764372 3.7799861 4.4958013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7260496e-10 1.7010213e-10 1.9725152e-10 ] [ 1.9146789e-10 2.0232509e-10 4.2404275e-10 ] [ 2.5626136e-10 3.9651636e-10 9.806404e-11 ] [ 2.4276679e-10 5.2603383e-10 2.996449e-10 ] [ 5.009828800000001e-10 2.5919674e-10 2.8615227e-10 ] [ 4.991676799999999e-10 4.0630854e-10 9.273448e-11 ] [ 3.5764372e-10 3.7799861e-10 4.4958013e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.6e-06 -1.31e-05 -3.3e-06 ] [ -2.11e-05 1.83e-05 -1.44e-05 ] [ -1.6e-06 -9e-06 3.1e-06 ] [ -1.42e-05 -9.1e-06 7e-06 ] [ 1.62e-05 -1.82e-05 5.8e-06 ] [ -6.7e-06 1.82e-05 8.8e-06 ] [ 3e-05 1.3e-05 -7.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.16565921408e-15 -2.098851373248e-14 -5.28718284864e-15 ] [ -3.380592669888e-14 2.931983216064e-14 -2.307134333952e-14 ] [ -2.56348259328e-15 -1.44195895872e-14 4.96674752448e-15 ] [ -2.275090801536e-14 -1.457980724928e-14 1.12152363456e-14 ] [ 2.595526125696e-14 -2.915961449856e-14 9.292624400640001e-15 ] [ -1.073458335936e-14 2.915961449856e-14 1.409915426304e-14 ] [ 4.8065298624e-14 2.08282960704e-14 -1.137545400768e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }