{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.31945 0 0 ] "si-unit" "m" "si-value" [ 5.31945e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00383334 5.41695 0 ] "si-unit" "m" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0189848 -0.118491 5.47074 ] "si-unit" "m" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0147515 -0.0960157 0.0381768 ] [ 1.54242 1.27348 1.38773 ] [ -0.0738039 2.51333 2.6891 ] [ 1.45374 4.04036 4.07661 ] [ 2.81495 -0.0309523 2.80877 ] [ 4.27456 1.30079 3.98727 ] [ 2.73206 2.74248 -0.103972 ] [ 3.9224 4.04214 1.39211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.47515e-12 -9.60157e-12 3.81768e-12 ] [ 1.54242e-10 1.27348e-10 1.38773e-10 ] [ -7.38039e-12 2.51333e-10 2.6891e-10 ] [ 1.45374e-10 4.04036e-10 4.07661e-10 ] [ 2.81495e-10 -3.09523e-12 2.80877e-10 ] [ 4.27456e-10 1.30079e-10 3.98727e-10 ] [ 2.73206e-10 2.74248e-10 -1.03972e-11 ] [ 3.9224e-10 4.04214e-10 1.39211e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3077375 1.2539747 -0.1067343 ] [ -1.515803 0.4010403 -0.8102007 ] [ 4.6844277 4.5891754 -3.3327186 ] [ -1.3171277 -1.2147666 -0.3591493 ] [ -0.6374238 0.3268132 -0.1666553 ] [ -4.1827741 -3.2059652 4.7854606 ] [ 0.251465 -1.0728843 0.2963979 ] [ 1.4094986 -1.0773874 -0.3064003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.095226465905575e-09 2.00908896396716e-09 -1.710072015063462e-10 ] [ -2.428584148347102e-09 6.425373979523501e-10 -1.298084630390444e-09 ] [ 7.50528060460236e-09 7.352669595207603e-09 -5.339603868617192e-09 ] [ -2.110271224934161e-09 -1.946270662283624e-09 -5.754206165774562e-10 ] [ -1.021265518315489e-09 5.236124727227688e-10 -2.670112275922602e-10 ] [ -6.701542928320378e-09 -5.136522532857136e-09 7.667153156247621e-09 ] [ 4.028913472688099e-10 -1.718950156445446e-09 4.748817897466685e-10 ] [ 2.258265722575712e-09 -1.726164918046012e-09 -4.909074013105901e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.350604 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.663791172658692e-18 } }