{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.945034 -0.5409769 -0.2192952 ] [ -1.9176922 -0.6367558 1.3438343 ] [ -0.1330606 1.270732 -1.0561161 ] [ 0.5089845 0.2202878 -0.4648318 ] [ 0.5967342 -0.3132871 0.3964087 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.514111380661107e-09 -8.667405415728595e-10 -3.513496424936602e-10 ] [ -3.072481608730518e-09 -1.020195255918801e-09 2.153059897689133e-09 ] [ -2.131865824696205e-10 2.035937101702426e-09 -1.692084524270475e-09 ] [ 8.154830662495776e-10 3.529399630074662e-10 -7.447426425643815e-10 ] [ 9.560735840717914e-10 -5.019412672182316e-10 6.35116751421721e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.478887 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.479991086740505e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9133381 1.1995102 2.0108543 ] [ 1.0434346 1.9579933 3.4192203 ] [ 1.8466185 3.3938553 1.6910507 ] [ 3.2347517 1.8628638 4.3586149 ] [ 4.0379371 3.2987255 2.6304459 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9133381e-10 1.1995102e-10 2.0108543e-10 ] [ 1.0434346e-10 1.9579933e-10 3.4192203e-10 ] [ 1.8466185e-10 3.3938553e-10 1.6910507e-10 ] [ 3.2347517e-10 1.8628638e-10 4.3586149e-10 ] [ 4.0379371e-10 3.298725500000001e-10 2.6304459e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.6e-06 -6.3e-06 3.2e-06 ] [ 6.1e-06 -6.1e-06 4.9e-06 ] [ 1.04e-05 1.16e-05 -4.2e-06 ] [ -6.3e-06 -6.8e-06 7e-06 ] [ -8.6e-06 7.5e-06 -1.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.56348259328e-15 -1.009371271104e-14 5.126965186560001e-15 ] [ 9.77327738688e-15 -9.77327738688e-15 7.850665441919999e-15 ] [ 1.666263685632e-14 1.858524880128e-14 -6.72914180736e-15 ] [ -1.009371271104e-14 -1.089480102144e-14 1.12152363456e-14 ] [ -1.377871893888e-14 1.2016324656e-14 -1.746372516672e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }