{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7345894 -0.9226062 0.5726004 ] [ 0.4777264 1.4760508 0.3251028 ] [ -2.9618845 1.9102039 3.7119967 ] [ 8.3904871 -13.0087057 -19.6140722 ] [ -1.9588214 0.5304897 23.6809295 ] [ -3.2129181 10.0145676 -8.6765572 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.176941972264079e-09 -1.478178096023531e-09 9.174069814990535e-10 ] [ 7.654020755249375e-10 2.364894102357007e-09 5.208721098079752e-10 ] [ -4.745462138506773e-09 3.060484054755672e-09 5.947274378225107e-09 ] [ 1.344304237949842e-08 -2.084224431112261e-08 -3.142520817642897e-08 ] [ -3.138377877259167e-09 8.499382019176697e-10 3.79410319163013e-08 ] [ -5.147662306775675e-09 1.604510620833346e-08 -1.390137720940446e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.4804737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.178510271391525e-19 } "relaxed-configuration-positions" { "source-value" [ [ -1.1094412 0.9629102 1.9839231 ] [ 0.3329384 2.5379824 0.6855211 ] [ 0.8301446 2.0801619 3.0961067 ] [ 3.9257747 1.2817261 1.005923 ] [ 3.0303621 1.3291552 3.1397164 ] [ 2.2883666 2.0123821 -0.457674 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.1094412e-10 9.629102e-11 1.9839231e-10 ] [ 3.329384e-11 2.5379824e-10 6.855211e-11 ] [ 8.301446000000001e-11 2.0801619e-10 3.0961067e-10 ] [ 3.9257747e-10 1.2817261e-10 1.005923e-10 ] [ 3.0303621e-10 1.3291552e-10 3.1397164e-10 ] [ 2.2883666e-10 2.0123821e-10 -4.576740000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.15e-05 9e-07 2e-05 ] [ 8e-07 1.43e-05 1.24e-05 ] [ -1.5e-06 -1.86e-05 -1.7e-05 ] [ 2.1e-06 -3e-07 1.44e-05 ] [ -2.42e-05 1.03e-05 -2.23e-05 ] [ 1.13e-05 -6.6e-06 -7.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.8425031291e-14 1.4419589706e-15 3.204353268e-14 ] [ 1.2817413072e-15 2.29111258662e-14 1.98669902616e-14 ] [ -2.403264951e-15 -2.98004853924e-14 -2.723700277799999e-14 ] [ 3.364570931399999e-15 -4.806529901999999e-16 2.30713435296e-14 ] [ -3.877267454279999e-14 1.65024193302e-14 -3.572853893819999e-14 ] [ 1.81045959642e-14 -1.05743657844e-14 -1.2016324755e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.737143 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.361150616651666e-18 } }