{ "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" [ [ 2.264039 2.962814 1.145416 ] [ 2.607686 1.947625 3.138097 ] [ 3.569117 1.227918 0.4731936 ] [ 5.155867 2.512325 3.932817 ] [ 4.543954 3.206398 1.939601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.264039e-10 2.962814e-10 1.145416e-10 ] [ 2.607686e-10 1.947625e-10 3.138097e-10 ] [ 3.569117e-10 1.227918e-10 4.731936e-11 ] [ 5.155867e-10 2.512325e-10 3.932817e-10 ] [ 4.543954e-10 3.206398e-10 1.939601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2314423 1.2402016 -0.8489772 ] [ 3.8984762 0.6224365 3.1904028 ] [ 1.2966022 -0.3206452 -0.6025228 ] [ -3.3803192 -1.8078858 1.0880065 ] [ -0.583317 0.2658928 -2.8269093 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.972988079179218e-09 1.987022024969414e-09 -1.360211432638745e-09 ] [ 6.246047475845111e-09 9.972532164487409e-10 5.111588819208175e-09 ] [ 2.077385748432994e-09 -5.137302472442568e-10 -9.653479516122552e-10 ] [ -5.415868437701573e-09 -2.896552385700397e-09 1.743178591940121e-09 ] [ -9.34576867614978e-10 4.260072313088351e-10 -4.529208026897296e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.898761 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906391684775047e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3509234 2.8167629 1.4599137 ] [ 2.4728867 2.1230925 3.6624423 ] [ 3.807418 1.3557874 0.2717949 ] [ 4.7342828 2.4230966 3.7167992 ] [ 4.7751522 3.1383406 1.5181745 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3509234e-10 2.8167629e-10 1.4599137e-10 ] [ 2.4728867e-10 2.1230925e-10 3.6624423e-10 ] [ 3.807418e-10 1.3557874e-10 2.717949e-11 ] [ 4.7342828e-10 2.4230966e-10 3.7167992e-10 ] [ 4.7751522e-10 3.1383406e-10 1.5181745e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-05 -3.4e-06 -1.51e-05 ] [ -1.81e-05 8.7e-06 -1.1e-06 ] [ 1.11e-05 1.04e-05 1.12e-05 ] [ 3.63e-05 -9.6e-06 1.6e-06 ] [ -1.13e-05 -6.2e-06 3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8839179412e-14 -5.4474005556e-15 -2.41928671734e-14 ] [ -2.899939707539999e-14 1.39389367158e-14 -1.7623942974e-15 ] [ 1.77841606374e-14 1.66626369936e-14 1.79443783008e-14 ] [ 5.81590118142e-14 -1.53808956864e-14 2.5634826144e-15 ] [ -1.81045959642e-14 -9.9334951308e-15 5.607618218999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.985955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.240797030517547e-18 } }