{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9404507 1.8967117 0.044774 ] [ -1.5709801 -7.2697258 0.5630253 ] [ -6.6894432 -1.1256854 -1.7632779 ] [ 2.5964325 6.4863254 3.1145708 ] [ -1.2057225 0.096273 -1.3976203 ] [ 3.8593559 3.1204323 -0.0783456 ] [ 2.0699067 -3.2043312 -0.4831264 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.506768124554995e-09 3.038867142137823e-09 7.173585601969919e-11 ] [ -2.516987587962046e-09 -1.164738471638658e-08 9.020659725789062e-10 ] [ -1.071766950120954e-08 -1.803546830255896e-09 -2.82508262735332e-09 ] [ 4.159943448985296e-09 1.039223891078121e-08 4.990092519586353e-09 ] [ -1.931780400672528e-09 1.542463498142784e-10 -2.239234569415483e-09 ] [ 6.183369794326543e-09 4.999483677849172e-09 -1.255234886625485e-10 ] [ 3.31635612197728e-09 -5.13390453394001e-09 -7.740538229712691e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.301526 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.772010046136334e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0411086 1.3239603 2.2726112 ] [ 1.5681234 2.7673411 3.3238588 ] [ 1.2234383 4.0477584 1.4360139 ] [ 3.3956432 4.1604992 3.9277826 ] [ 4.8954091 2.6049155 3.0911326 ] [ 3.2054866 5.2078789 1.8469863 ] [ 3.8503818 3.1522112 0.8625201 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0411086e-10 1.3239603e-10 2.2726112e-10 ] [ 1.5681234e-10 2.7673411e-10 3.3238588e-10 ] [ 1.2234383e-10 4.047758400000001e-10 1.4360139e-10 ] [ 3.3956432e-10 4.1604992e-10 3.9277826e-10 ] [ 4.895409100000001e-10 2.6049155e-10 3.0911326e-10 ] [ 3.2054866e-10 5.2078789e-10 1.8469863e-10 ] [ 3.8503818e-10 3.1522112e-10 8.625201000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.59e-05 1.07e-05 -1.46e-05 ] [ 1.2e-06 4.8e-06 -1e-07 ] [ 9.87e-05 -8.3e-06 2.95e-05 ] [ -1.17e-05 1.45e-05 -3.1e-06 ] [ 5.1e-06 3.81e-05 8.9e-06 ] [ -3.77e-05 -6.88e-05 1.88e-05 ] [ -9.8e-06 9e-06 -3.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.353990689472e-14 1.714328984256e-14 -2.339177866368e-14 ] [ 1.92261194496e-15 7.69044777984e-15 -1.6021766208e-16 ] [ 1.5813483247296e-13 -1.329806595264e-14 4.72642103136e-14 ] [ -1.874546646336e-14 2.32315610016e-14 -4.96674752448e-15 ] [ 8.17110076608e-15 6.104292925248e-14 1.425937192512e-14 ] [ -6.040205860416e-14 -1.1022975151104e-13 3.012092047104e-14 ] [ -1.570133088384e-14 1.44195895872e-14 -6.296554119743999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.30335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573390593551968e-18 } }