{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4880277 -10.4938876 -21.2679079 ] [ -6.4238504 -11.1528424 4.1817957 ] [ 0.209569 15.1864651 19.5368646 ] [ -2.8663828 -44.738697 -12.1994761 ] [ 22.5980328 -40.5234201 -11.402283 ] [ 6.8881486 46.407876 4.8303607 ] [ -15.9174894 45.314506 16.320646 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.190613054442797e-09 -1.681306137402302e-08 -3.407494481070763e-08 ] [ -1.029214292639673e-08 -1.786882334874696e-08 6.699975303501971e-09 ] [ 3.357665522444352e-10 2.433139933581513e-08 3.130150770585514e-08 ] [ -4.592451508423242e-09 -7.167929437845511e-08 -1.954571539342836e-08 ] [ 3.620603982823156e-08 -6.49256762790768e-08 -1.826847124634529e-08 ] [ 1.103603064751625e-08 7.435361394818543e-08 7.739090983571123e-09 ] [ -2.550262937851182e-08 7.260184209630133e-08 2.614855745755304e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.3413753 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.016000324937859e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4572812 2.3212615 0.801119 ] [ 2.6538159 1.453367 3.6765604 ] [ 1.9668894 3.8609395 2.8014722 ] [ 3.9468787 1.8449989 1.2706834 ] [ 5.325839 1.2720132 3.4522956 ] [ 4.3104925 4.3778919 1.6744631 ] [ 4.3324053 3.600107 4.1956073 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4572812e-10 2.3212615e-10 8.01119e-11 ] [ 2.6538159e-10 1.453367e-10 3.6765604e-10 ] [ 1.9668894e-10 3.8609395e-10 2.8014722e-10 ] [ 3.9468787e-10 1.8449989e-10 1.2706834e-10 ] [ 5.325839e-10 1.2720132e-10 3.4522956e-10 ] [ 4.3104925e-10 4.3778919e-10 1.6744631e-10 ] [ 4.3324053e-10 3.600107e-10 4.1956073e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.8e-06 -6e-06 -7.6e-06 ] [ -1e-07 1.1e-06 1e-07 ] [ -0.0 2e-07 5.8e-06 ] [ 1.13e-05 1e-07 1.78e-05 ] [ -1.34e-05 5.6e-06 -8e-06 ] [ 1.4e-06 9.9e-06 -1.04e-05 ] [ 6.7e-06 -1.09e-05 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.292624400640001e-15 -9.6130597248e-15 -1.217654231808e-14 ] [ -1.6021766208e-16 1.76239428288e-15 1.6021766208e-16 ] [ 0.0 3.2043532416e-16 9.292624400640001e-15 ] [ 1.810459581504e-14 1.6021766208e-16 2.851874385024e-14 ] [ -2.146916671872e-14 8.972189076479999e-15 -1.28174129664e-14 ] [ 2.24304726912e-15 1.586154854592e-14 -1.666263685632e-14 ] [ 1.073458335936e-14 -1.746372516672e-14 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.35204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.901626915678643e-18 } }