{ "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" [ [ 1.2534568 0.6775582 0.0379224 ] [ -2.4075695 -8.5769004 0.8327037 ] [ -9.4500832 -1.2432476 -2.3671171 ] [ 2.5992999 8.5844748 5.0413245 ] [ 0.0661865 -0.9525808 -0.4095463 ] [ 5.5482699 4.9626065 -0.5894802 ] [ 2.3904395 -3.4519107 -2.545807 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.008259180142781e-09 1.085567907271331e-09 6.075838268462592e-11 ] [ -3.857351565851146e-09 -1.374170929981017e-08 1.334138400193657e-09 ] [ -1.514070236765485e-08 -1.99190223858571e-09 -3.792539676315896e-09 ] [ 4.164537530227778e-09 1.375384482640676e-08 8.07709225176625e-09 ] [ 1.060424629125792e-10 -1.52620268718296e-09 -6.56165506995143e-10 ] [ 8.889308319668355e-09 7.950972112530114e-09 -9.444513948645081e-10 ] [ 3.829906280336842e-09 -5.530570620629363e-09 -4.078832456468985e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.400728 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.826597986169994e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.5375214 1.3861332 1.8386004 ] [ 1.782491 2.3101991 3.4739256 ] [ 1.3822147 4.1983746 1.8734889 ] [ 3.284084 4.5419296 3.7672468 ] [ 4.3419038 2.296118 4.0397925 ] [ 3.6924729 5.3596239 1.4431211 ] [ 3.1589031 3.1721863 0.3247303 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.5375214e-10 1.3861332e-10 1.8386004e-10 ] [ 1.782491e-10 2.3101991e-10 3.4739256e-10 ] [ 1.3822147e-10 4.1983746e-10 1.8734889e-10 ] [ 3.284084e-10 4.5419296e-10 3.7672468e-10 ] [ 4.3419038e-10 2.296118e-10 4.0397925e-10 ] [ 3.6924729e-10 5.3596239e-10 1.4431211e-10 ] [ 3.1589031e-10 3.1721863e-10 3.247303e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.5e-06 -2.49e-05 1.22e-05 ] [ 4.3e-06 4.47e-05 -3e-06 ] [ 8.04e-05 -1.43e-05 6.09e-05 ] [ -6.65e-05 -2.48e-05 -8.22e-05 ] [ 1.52e-05 -1.88e-05 4.61e-05 ] [ -1.86e-05 -6.1e-06 1.31e-05 ] [ -1.94e-05 4.41e-05 -4.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.2097947936e-15 -3.989419785791999e-14 1.954655477376e-14 ] [ 6.889359469440001e-15 7.161729494976001e-14 -4.8065298624e-15 ] [ 1.2881500031232e-13 -2.291112567744e-14 9.757255620672e-14 ] [ -1.065447452832e-13 -3.973398019584e-14 -1.3169891822976e-13 ] [ 2.435308463616e-14 -3.012092047104e-14 7.386034221888001e-14 ] [ -2.980048514688e-14 -9.77327738688e-15 2.098851373248e-14 ] [ -3.108222644352e-14 7.065598897728e-14 -7.546251883968001e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.016851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.72640008318371e-18 } }