{ "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" [ [ 2.051273 2.837998 1.545633 ] [ 2.498541 2.310424 3.735737 ] [ 1.453493 4.519355 3.131974 ] [ 4.173987 2.427158 6.121254 ] [ 4.520065 2.264664 3.31985 ] [ 3.501394 4.313188 2.351729 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.051273e-10 2.837998e-10 1.545633e-10 ] [ 2.498541e-10 2.310424e-10 3.735737e-10 ] [ 1.453493e-10 4.519355e-10 3.131974e-10 ] [ 4.173987e-10 2.427158e-10 6.121254e-10 ] [ 4.520065e-10 2.264664e-10 3.31985e-10 ] [ 3.501394e-10 4.313188e-10 2.351729e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4572337 -3.5159931 -5.7640905 ] [ -8.8711981 -7.1419413 8.1472628 ] [ -5.0690303 2.2406547 2.9290022 ] [ 0.0 0.0 0.0 ] [ 6.9514745 -0.0889689 -0.8893737 ] [ 10.4459876 8.5062486 -4.4228008 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.539099052417366e-09 -5.633241990125225e-09 -9.235091115361375e-09 ] [ -1.42132263114052e-08 -1.144265147225958e-08 1.305335408921741e-08 ] [ -8.121481903698009e-09 3.589924605202279e-09 4.692778885774595e-09 ] [ 0.0 0.0 0.0 ] [ 1.113749001574683e-08 -1.425438927326826e-10 -1.424933761034126e-09 ] [ 1.673631725177374e-08 1.362851274991521e-08 -7.086108098596507e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8214815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.092921826856327e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9964067 3.0004244 1.1184284 ] [ 1.8882996 2.0395691 3.43321 ] [ 1.295776 4.4499199 3.0695308 ] [ 5.0919106 2.5750886 6.1070208 ] [ 4.204126 2.3989613 3.9977867 ] [ 3.7222343 4.2088237 2.4802002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9964067e-10 3.0004244e-10 1.1184284e-10 ] [ 1.8882996e-10 2.0395691e-10 3.43321e-10 ] [ 1.295776e-10 4.449919900000001e-10 3.0695308e-10 ] [ 5.0919106e-10 2.5750886e-10 6.1070208e-10 ] [ 4.204125999999999e-10 2.3989613e-10 3.9977867e-10 ] [ 3.7222343e-10 4.2088237e-10 2.4802002e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.25e-05 -7.61e-05 -0.0001032 ] [ 5.01e-05 -4.54e-05 4.61e-05 ] [ -7.27e-05 8.72e-05 4.92e-05 ] [ -2.89e-05 -1.32e-05 3.03e-05 ] [ 1.62e-05 -3.64e-05 -1.2e-05 ] [ 9.79e-05 8.39e-05 -1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.00136039625e-13 -1.219256418474e-13 -1.653446286288e-13 ] [ 8.026904936339999e-14 -7.273881918359998e-14 7.386034282739999e-14 ] [ -1.164782412918e-13 1.397098024848e-13 7.882709039280001e-14 ] [ -4.63029047226e-14 -2.11487315688e-14 4.854595201019999e-14 ] [ 2.59552614708e-14 -5.831922947759999e-14 -1.9226119608e-14 ] [ 1.568530924686e-13 1.344226195926e-13 -1.66626369936e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.34033 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137356501584922e-18 } }