{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.9274523 1.2053532 -18.3950305 ] [ -17.7801357 -8.3237825 3.381999 ] [ -11.0705135 16.3473342 -0.3750391 ] [ 10.666283 -10.1128722 -10.8591463 ] [ 4.234048 -15.9846411 9.8359619 ] [ 16.963283 8.9835044 -0.2041403 ] [ 2.9144875 7.885104 16.6153953 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.496825495967188e-09 1.931188716846466e-09 -2.947208780600294e-08 ] [ -2.848691773319144e-08 -1.333616971812418e-08 5.41855972936898e-09 ] [ -1.773691790995078e-08 2.619131666764427e-08 -6.008788779058732e-10 ] [ 1.708926925343649e-08 -1.620260740797826e-08 -1.739827032370682e-08 ] [ 6.783692716944999e-09 -2.561021826229879e-08 1.575894819925955e-08 ] [ 2.717817543461409e-08 1.439316072253393e-08 -3.270688160230982e-10 ] [ 4.66952373411384e-09 1.263332928137656e-08 2.66207978950102e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 146.55895 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.348133232589962e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.571525 3.0757746 -4.248674 ] [ -3.9383464 -0.2561658 4.217782 ] [ -1.2506893 9.558552 3.1441014 ] [ 8.4532966 -2.7268808 -2.1976099 ] [ 5.0347537 -3.5465405 7.1641058 ] [ 8.9500946 6.249121 2.312815 ] [ 3.7479908 5.6505295 10.8733028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.71525e-11 3.0757746e-10 -4.248674000000001e-10 ] [ -3.9383464e-10 -2.561658e-11 4.217782e-10 ] [ -1.2506893e-10 9.558552000000002e-10 3.1441014e-10 ] [ 8.453296600000001e-10 -2.7268808e-10 -2.1976099e-10 ] [ 5.034753700000001e-10 -3.5465405e-10 7.1641058e-10 ] [ 8.950094600000001e-10 6.249121e-10 2.312815e-10 ] [ 3.7479908e-10 5.6505295e-10 1.08733028e-09 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 0.0 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 0.0 } }