{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.2057963 -1.6432112 1.1990124 ] [ -1.8933393 -3.6566499 -0.7425361 ] [ -3.2649377 2.3031892 2.6742148 ] [ -0.6490681 2.1660616 0.3343961 ] [ -0.5190377 0.2908743 -1.712661 ] [ 2.1007969 -1.2983426 0.6349972 ] [ 1.0197896 1.8380786 -2.3874233 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.136251882907143e-09 -2.632714567676713e-09 1.921029635329298e-09 ] [ -3.033463961701838e-09 -5.858598980230659e-09 -1.189673979520011e-09 ] [ -5.231006851308524e-09 3.690115889519055e-09 4.284564431557348e-09 ] [ -1.039921735127076e-09 3.470413254732641e-09 5.357616135066989e-10 ] [ -8.315900682538042e-10 4.660320030515653e-10 -2.743985413555949e-09 ] [ 3.365847678229116e-09 -2.080174159508686e-09 1.017377668113462e-09 ] [ 1.633883055254984e-09 2.944926560112795e-09 -3.825073795213184e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.864604 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.784837031825017e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5249594 1.3635929 2.3843462 ] [ 2.7078847 0.2115882 3.9999256 ] [ 2.1288059 2.4827555 4.7791111 ] [ 1.7154962 3.6985489 2.8368989 ] [ 4.06148 1.1435441 2.1610812 ] [ 4.4475294 1.6659537 4.5401658 ] [ 4.0683294 3.4899754 3.1742631 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5249594e-10 1.3635929e-10 2.3843462e-10 ] [ 2.7078847e-10 2.115882e-11 3.9999256e-10 ] [ 2.1288059e-10 2.4827555e-10 4.7791111e-10 ] [ 1.7154962e-10 3.6985489e-10 2.8368989e-10 ] [ 4.061480000000001e-10 1.1435441e-10 2.1610812e-10 ] [ 4.4475294e-10 1.6659537e-10 4.5401658e-10 ] [ 4.0683294e-10 3.4899754e-10 3.1742631e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.34e-05 2.15e-05 2.83e-05 ] [ -6.5e-06 -1.98e-05 -3.59e-05 ] [ 2.07e-05 -3.97e-05 -1.92e-05 ] [ 4.21e-05 -5.75e-05 -1.19e-05 ] [ -5.57e-05 5.6e-05 3.35e-05 ] [ -1.78e-05 4.41e-05 3.83e-05 ] [ 3.06e-05 -4.6e-06 -3.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.146916671872e-14 3.44467973472e-14 4.534159836864e-14 ] [ -1.04141480352e-14 -3.172309709184e-14 -5.751814068672e-14 ] [ 3.316505605055999e-14 -6.360641184576e-14 -3.076179111936e-14 ] [ 6.745163573568001e-14 -9.212515569600001e-14 -1.906590178752e-14 ] [ -8.924123777856e-14 8.97218907648e-14 5.36729167968e-14 ] [ -2.851874385024e-14 7.065598897728e-14 6.136336457664001e-14 ] [ 4.902660459647999e-14 -7.370012455680001e-15 -5.319226381056e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.196266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.158410466225794e-18 } }