{ "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" [ [ 1.2704009 1.2332369 -0.1418078 ] [ -1.4489984 0.406883 -0.8544122 ] [ 4.3643787 4.3516317 -3.2107387 ] [ -1.2856156 -1.1541599 -0.2834493 ] [ -0.6092404 0.3171716 -0.0998022 ] [ -3.8746761 -3.0573614 4.6114944 ] [ 0.2422088 -1.0268604 0.2720259 ] [ 1.3415421 -1.0705415 -0.2933101 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.035406621023279e-09 1.975863329087868e-09 -2.272011418070823e-10 ] [ -2.321551360056607e-09 6.518984300009665e-10 -1.368919251366294e-09 ] [ 6.992505517457497e-09 6.97208257207216e-09 -5.144170480637785e-09 ] [ -2.059783257655765e-09 -1.849168008444866e-09 -4.541358416421255e-10 ] [ -9.761107253268404e-10 5.081649223017292e-10 -1.599007515444057e-10 ] [ -6.207915460592523e-09 -4.898432956416357e-09 7.388428514630123e-09 ] [ 3.88061276712023e-10 -1.645211725705336e-09 4.358335372320787e-10 ] [ 2.149387388438936e-09 -1.715196562896163e-09 -4.699345848645101e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.436578 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.677565679275562e-18 } }