{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4002361 -2.0704158 -3.0711147 ] [ -3.0899813 -5.6190211 12.2734133 ] [ -7.0284709 3.5641125 -4.0194097 ] [ 2.9298072 0.6087177 -10.1861131 ] [ 4.0331359 -1.7243959 3.1205665 ] [ 1.5560656 0.621563 -1.2640936 ] [ 2.9996795 4.6194396 3.1467513 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.243425543020171e-09 -3.317171790094929e-09 -4.920468172135206e-09 ] [ -4.950695797569191e-09 -9.002664238201899e-09 1.966417584667578e-08 ] [ -1.126085175595314e-08 5.71033772140104e-09 -6.439804250756742e-09 ] [ 4.69406859929151e-09 9.752732676071482e-10 -1.631995226564461e-08 ] [ 6.461796047489167e-09 -2.762786795983375e-09 4.999698689951684e-09 ] [ 2.493091924751124e-09 9.958537069543105e-10 -2.025301212422907e-09 ] [ 4.806016364793033e-09 7.401158128317704e-09 5.041651364332007e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.430236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.311978675182651e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0303412 1.7400312 2.7199918 ] [ 3.1750533 2.0166589 4.8750972 ] [ 1.2510565 4.0374891 2.4837793 ] [ 4.3023288 2.0885255 1.8551244 ] [ 5.2510189 1.3348541 3.9125441 ] [ 3.725264 4.4194591 2.0623419 ] [ 2.8384373 4.3629241 4.4381284 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0303412e-10 1.7400312e-10 2.7199918e-10 ] [ 3.1750533e-10 2.0166589e-10 4.8750972e-10 ] [ 1.2510565e-10 4.0374891e-10 2.4837793e-10 ] [ 4.3023288e-10 2.0885255e-10 1.8551244e-10 ] [ 5.2510189e-10 1.3348541e-10 3.9125441e-10 ] [ 3.725264e-10 4.4194591e-10 2.0623419e-10 ] [ 2.8384373e-10 4.3629241e-10 4.4381284e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.61e-05 4.3e-05 6e-07 ] [ -1.36e-05 3.99e-05 2.45e-05 ] [ -1.87e-05 -2.73e-05 -3.25e-05 ] [ 1.42e-05 7.7e-06 -7.6e-06 ] [ 1.89e-05 -5.62e-05 -6.7e-06 ] [ -3.26e-05 7.3e-06 1.9e-06 ] [ 1.56e-05 -1.44e-05 1.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.579504359488e-14 6.889359469439999e-14 9.6130597248e-16 ] [ -2.178960204288e-14 6.392684716992e-14 3.92533272096e-14 ] [ -2.996070280896e-14 -4.373942174784e-14 -5.207074017599999e-14 ] [ 2.275090801536e-14 1.233675998016e-14 -1.217654231808e-14 ] [ 3.028113813312e-14 -9.004232608896e-14 -1.073458335936e-14 ] [ -5.223095783807999e-14 1.169588933184e-14 3.04413557952e-15 ] [ 2.499395528448e-14 -2.307134333952e-14 3.172309709184e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.078105 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.896431717936759e-18 } }