{ "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" [ [ 0.284773 1.136187 2.117179 ] [ 0.232979 2.36751 0.607179 ] [ 0.4870779 2.766051 2.845032 ] [ 1.778488 1.070505 1.035652 ] [ 2.177899 0.7799475 2.527686 ] [ 2.528264 2.860392 0.629956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84773e-11 1.136187e-10 2.117179e-10 ] [ 2.32979e-11 2.36751e-10 6.07179e-11 ] [ 4.870779e-11 2.766051e-10 2.845032e-10 ] [ 1.778488e-10 1.070505e-10 1.035652e-10 ] [ 2.177899e-10 7.799475000000001e-11 2.527686e-10 ] [ 2.528264e-10 2.860392e-10 6.29956e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.9846672 -8.319518 3.4263964 ] [ -2.4421874 4.5402686 -3.861218 ] [ -0.9963218 8.154238 6.2539185 ] [ 4.2389695 -5.9924683 -19.036431 ] [ 6.6742083 -2.7071079 15.1222444 ] [ 2.5099986 4.3245877 -1.9049103 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.59972004861062e-08 -1.332933734574241e-08 5.489692250901716e-09 ] [ -3.912815588129211e-09 7.274312263003891e-09 -6.186353258380212e-09 ] [ -1.596283507904821e-09 1.306452959167489e-08 1.001988209164033e-08 ] [ 6.791577885138662e-09 -9.600992690245701e-09 -3.049972494295325e-08 ] [ 1.069326058870886e-08 -4.337265023096808e-09 2.422850663131735e-08 ] [ 4.021461108292712e-09 6.928753364623802e-09 -3.05200277252593e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.100650319227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.569966125671113e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2753251 0.7524959 2.0464847 ] [ -0.1291395 2.4335995 0.445176 ] [ 1.4932387 3.0370858 2.9164025 ] [ 2.4289889 0.8561206 0.7126073 ] [ 1.8823817 0.7613179 2.9540943 ] [ 2.0893363 3.1399729 0.6879192 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.753251e-11 7.524959000000001e-11 2.0464847e-10 ] [ -1.291395e-11 2.4335995e-10 4.45176e-11 ] [ 1.4932387e-10 3.0370858e-10 2.9164025e-10 ] [ 2.4289889e-10 8.561206e-11 7.126073e-11 ] [ 1.8823817e-10 7.613179e-11 2.9540943e-10 ] [ 2.0893363e-10 3.1399729e-10 6.879192e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.32e-05 5.37e-05 2.22e-05 ] [ 8.39e-05 -6.49e-05 -2e-06 ] [ 5.8e-06 -6.29e-05 -5.89e-05 ] [ -7.78e-05 5.52e-05 1.26e-05 ] [ -2.43e-05 4.2e-06 -1.41e-05 ] [ -3.08e-05 1.48e-05 4.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.92140305888e-14 8.603688524579999e-14 3.55683212748e-14 ] [ 1.344226195926e-13 -1.039812635466e-13 -3.204353268e-15 ] [ 9.2926244772e-15 -1.007769102786e-13 -9.436820374259999e-14 ] [ -1.246493421252e-13 8.844015019679999e-14 2.01874255884e-14 ] [ -3.893289220619999e-14 6.729141862799999e-15 -2.25906905394e-14 ] [ -4.93470403272e-14 2.37122141832e-14 6.456771835019998e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.185693719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.593234028202703e-18 } }