{ "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" [ [ 1.3718686 1.1593816 -0.0182718 ] [ -1.4512147 0.3173568 -0.882812 ] [ 3.9755619 3.7970457 -2.7026824 ] [ -1.5064828 -1.2432368 -0.2063251 ] [ -0.6195548 0.3677801 -0.1211643 ] [ -3.0029284 -2.3794871 4.1028885 ] [ 0.1771449 -0.9247278 0.1746857 ] [ 1.0556054 -1.0941125 -0.3463187 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.197975797729627e-09 1.857534094105697e-09 -2.927465077993344e-11 ] [ -2.325102264101286e-09 5.084616454119014e-10 -1.41442074696169e-09 ] [ 6.369552330723227e-09 6.083537848649171e-09 -4.330174554727634e-09 ] [ -2.413651521797322e-09 -1.991884935078205e-09 -3.305692515042221e-10 ] [ -9.926362158644199e-10 5.892486778154861e-10 -1.941266087355975e-10 ] [ -4.811221676416351e-09 -3.812358601115191e-09 6.57355203244918e-09 ] [ 2.83817417273954e-10 -1.481577261763818e-09 2.798773445280826e-10 ] [ 1.691266292670232e-09 -1.75296146802504e-09 -5.548637244858489e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.362727 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.665733444713292e-18 } }