{ "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" [ 5.43079 0 0 ] "si-unit" "m" "si-value" [ 5.43079e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0839771 5.43297 0 ] "si-unit" "m" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0398452 0.0785902 5.46584 ] "si-unit" "m" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6050269 0.368333 -3.5825097 ] [ -1.0939393 0.5196611 0.8038043 ] [ -0.2761269 -0.6377805 -1.9477825 ] [ -1.7382297 0.0905374 4.1561066 ] [ 4.8707455 0.6643964 -1.9266382 ] [ -0.6439268 -2.8125421 -0.468294 ] [ -0.2929873 1.3110379 -0.263789 ] [ -2.4305623 0.4963569 3.2291025 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.571536596121454e-09 5.901345261311219e-10 -5.739813332418349e-09 ] [ -1.752683985474316e-09 8.325888720187373e-10 1.287836467768726e-09 ] [ -4.424040671988546e-10 -1.021837014720837e-09 -3.120691609614104e-09 ] [ -2.784951009864829e-09 1.450569067831116e-10 6.658816882933184e-09 ] [ 7.803794630260646e-09 1.064480387793718e-09 -3.086814706211819e-09 ] [ -1.031684472966391e-09 -4.506189234761291e-09 -7.502897046423959e-10 ] [ -4.694174061187482e-10 2.100514289668428e-09 -4.22636572106226e-10 ] [ -3.894190124541298e-09 7.952514273046744e-10 5.173592574290986e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.721025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.723139159752984e-18 } }