{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3768386 0.9256711 -1.0752163 ] [ 2.5111797 1.1377242 -1.0793399 ] [ -0.1967445 -2.0441717 -0.8921029 ] [ -0.6764997 -0.0452899 1.5433091 ] [ -0.0173229 0.7585059 0.3220049 ] [ -0.2522558 -1.6365752 2.5171337 ] [ -0.9915182 0.9041355 -1.3357885 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.03761994735003e-10 1.483088594970219e-09 -1.722686418163079e-09 ] [ 4.023353405967558e-09 1.822835114158384e-09 -1.72929315367661e-09 ] [ -3.152194381709856e-10 -3.275124106640992e-09 -1.42930640972788e-09 ] [ -1.083872003318214e-09 -7.256241893836993e-11 2.472653758687889e-09 ] [ -2.775434538445632e-11 1.215260419718863e-09 5.159087225630419e-10 ] [ -4.041583452212006e-10 -2.622082523621084e-09 4.032892765567802e-09 ] [ -1.588587279137699e-09 1.448584760135319e-09 -2.140169105033501e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.251839 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.366225931960565e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4047563 2.3849068 1.8494616 ] [ 2.9489665 4.6978721 3.9908896 ] [ 1.1863181 3.226449 3.6622061 ] [ 4.6800539 2.6024702 1.3422351 ] [ 3.3566383 2.3505931 4.0001197 ] [ 3.3695366 4.5312638 1.6739743 ] [ 5.0128454 3.858435 3.2655968 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4047563e-10 2.3849068e-10 1.8494616e-10 ] [ 2.9489665e-10 4.6978721e-10 3.9908896e-10 ] [ 1.1863181e-10 3.226449e-10 3.6622061e-10 ] [ 4.6800539e-10 2.6024702e-10 1.3422351e-10 ] [ 3.3566383e-10 2.3505931e-10 4.0001197e-10 ] [ 3.3695366e-10 4.5312638e-10 1.6739743e-10 ] [ 5.0128454e-10 3.858435e-10 3.2655968e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.44e-05 -6.43e-05 -5.57e-05 ] [ 1.44e-05 1.09e-05 8.09e-05 ] [ -3.29e-05 1.81e-05 -2.94e-05 ] [ 3.8e-05 -2.7e-05 -5.8e-05 ] [ -9.7e-06 4.56e-05 9.47e-05 ] [ -1.87e-05 4.43e-05 3.36e-05 ] [ -2.57e-05 -2.77e-05 -6.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.511487575552001e-14 -1.0301995671744e-13 -8.924123777856e-14 ] [ 2.307134333952e-14 1.746372516672e-14 1.2961608862272e-13 ] [ -5.271161082432e-14 2.899939683648e-14 -4.710399265152e-14 ] [ 6.08827115904e-14 -4.32587687616e-14 -9.29262440064e-14 ] [ -1.554111322176e-14 7.305925390848e-14 1.5172612598976e-13 ] [ -2.996070280896e-14 7.097642430144e-14 5.383313445888e-14 ] [ -4.117593915456e-14 -4.438029239616e-14 -1.0590387463488e-13 ] ] } "relaxed-potential-energy" { "source-value" -30.311464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.856431896302086e-18 } }