{ "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" [ [ -0.8096341 -0.67536 -0.2344881 ] [ 1.1223289 0.2739366 0.3507205 ] [ -3.6173225 -4.3037294 3.5090727 ] [ 1.0332643 1.0744982 0.0190296 ] [ 0.2857903 -0.4846118 0.185001 ] [ 3.4986335 2.8372581 -4.1993254 ] [ -0.2992764 0.5326956 0.3122011 ] [ -1.2137841 0.7453127 0.0577884 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.297176837109619e-09 -1.08204601153824e-09 -3.756913547710554e-10 ] [ 1.798169139242923e-09 4.388948197174043e-10 5.619161901647969e-10 ] [ -5.795589587142465e-09 -6.895334683738839e-09 5.622154286947291e-09 ] [ 1.655471918206366e-09 1.721535909315059e-09 3.04887804743664e-11 ] [ 4.578865408838501e-10 -7.764337025206811e-10 2.96404279466634e-10 ] [ 5.605428844629638e-09 4.545788632447235e-09 -6.728061034442703e-09 ] [ -4.794936551876376e-10 8.534724433546105e-10 5.002013075290974e-10 ] [ -1.944696523740719e-09 1.194122592963452e-09 9.258722419624559e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -0.07920560156247802 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.269013641053162e-20 } }