{ "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" [ [ 0.0964554 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.0320969 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.64554e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.20969e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1190636 -1.1285507 -3.1823823 ] [ 0.0480524 -3.2585458 3.3711999 ] [ 1.9500508 2.7784051 -2.515844 ] [ -1.2486302 2.9301399 2.068994 ] [ 2.7806675 -2.6718309 -1.3759888 ] [ 0.5889231 1.3503824 1.6340212 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.599467453879921e-09 -1.808137561824343e-09 -5.098738561515178e-09 ] [ 7.69884324876216e-11 -5.220765941578836e-09 5.401257708323136e-09 ] [ 3.124325826873007e-09 4.451495731006433e-09 -4.030826471589095e-09 ] [ -2.000526130946747e-09 4.694601682131097e-09 3.314893842686195e-09 ] [ 4.455120495423195e-09 -4.28074503797919e-09 -2.204577104005699e-09 ] [ 9.435588300428454e-10 2.163551128244841e-09 2.617990586100641e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.609611 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.020282410802937e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0686315 0.3661174 0.9282945 ] [ -0.0681406 0.7100422 3.2186972 ] [ 0.7711764 2.6207489 0.631695 ] [ 0.6344029 2.9646735 2.9220976 ] [ 2.385543 0.9079472 0.9852904 ] [ 2.2487697 1.2518709 3.2756933 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.86315e-12 3.661174e-11 9.282945000000001e-11 ] [ -6.81406e-12 7.100422e-11 3.2186972e-10 ] [ 7.711764e-11 2.6207489e-10 6.316950000000001e-11 ] [ 6.344029e-11 2.9646735e-10 2.9220976e-10 ] [ 2.385543e-10 9.079472e-11 9.852904000000001e-11 ] [ 2.2487697e-10 1.2518709e-10 3.2756933e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 4.6e-06 2.5e-06 ] [ -2.2e-06 -1.8e-06 7e-07 ] [ -2.2e-06 5e-07 -1.8e-06 ] [ 6e-07 -1e-06 -1e-07 ] [ -2.1e-06 -2.8e-06 4e-07 ] [ -4e-07 4e-07 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.9334951308e-15 7.370012516399999e-15 4.005441585e-15 ] [ -3.5247885948e-15 -2.8839179412e-15 1.1215236438e-15 ] [ -3.5247885948e-15 8.010883169999999e-16 -2.8839179412e-15 ] [ 9.613059803999998e-16 -1.602176634e-15 -1.602176634e-16 ] [ -3.364570931399999e-15 -4.486094575199999e-15 6.408706536e-16 ] [ -6.408706536e-16 6.408706536e-16 -2.7237002778e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }