{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6953754 -22.3982717 -17.2390823 ] [ -6.8987021 9.7497426 -11.3986497 ] [ -14.5837172 3.0659637 16.9760168 ] [ 4.6399498 -10.8842949 -8.3993356 ] [ 14.1306548 -6.1581376 16.0921632 ] [ 13.4071901 26.624998 3.9688875 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.713588041655945e-08 -3.588598726406627e-08 -2.762005462510709e-08 ] [ -1.105293921848386e-08 1.56208096525378e-08 -1.826265005802893e-08 ] [ -2.336569074219884e-08 4.912215360361466e-09 2.719857723126803e-08 ] [ 7.434019091245636e-09 -1.743856282267268e-08 -1.345721912857314e-08 ] [ 2.26398047571553e-08 -9.866424090389422e-09 2.578248765713812e-08 ] [ 2.148068652884121e-08 4.265794932444676e-08 6.35885876308536e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.8827125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.102732105518792e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7703776 0.452651 -0.6238616 ] [ 0.1557327 2.4906884 0.4591839 ] [ 0.0692936 1.5824608 2.7850536 ] [ 2.4507926 -0.4064103 0.8455657 ] [ 2.5364913 1.2735608 2.541069 ] [ 2.4711349 3.2487669 1.0125781 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.703776e-11 4.52651e-11 -6.238616000000001e-11 ] [ 1.557327e-11 2.4906884e-10 4.591839e-11 ] [ 6.92936e-12 1.5824608e-10 2.7850536e-10 ] [ 2.4507926e-10 -4.064103e-11 8.455657e-11 ] [ 2.5364913e-10 1.2735608e-10 2.541069e-10 ] [ 2.4711349e-10 3.2487669e-10 1.0125781e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 2.42e-05 -2.06e-05 ] [ -4.37e-05 2.65e-05 -1.26e-05 ] [ 1.23e-05 -3.2e-06 -1.36e-05 ] [ 1.33e-05 -3.5e-05 3.35e-05 ] [ 3.32e-05 -2e-05 2.65e-05 ] [ -1.29e-05 7.5e-06 -1.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.52478856576e-15 3.877267422336e-14 -3.300483838848e-14 ] [ -7.001511832895999e-14 4.24576804512e-14 -2.018742542208e-14 ] [ 1.970677243584e-14 -5.126965186560001e-15 -2.178960204288e-14 ] [ 2.130894905664e-14 -5.6076181728e-14 5.36729167968e-14 ] [ 5.319226381056e-14 -3.2043532416e-14 4.24576804512e-14 ] [ -2.066807840832e-14 1.2016324656e-14 -2.098851373248e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }