{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5306769 1.7282795 -0.8162577 ] [ 0.9729277 -1.2880454 -0.5829597 ] [ 2.9285995 0.0349509 0.8172393 ] [ -0.0216586 -0.7513439 1.2134873 ] [ -0.0088913 0.7782046 -1.4935231 ] [ -1.4655719 -1.0830844 1.9197659 ] [ -0.7360753 -0.5910354 -0.3288643 ] [ -3.2000069 1.1720741 -0.7288877 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.45241474317862e-09 2.769009009107914e-09 -1.30778900348798e-09 ] [ 1.558802014668716e-09 -2.063676226408984e-09 -9.340044022085818e-10 ] [ 4.69213365058657e-09 5.599751485591872e-11 1.309361700058958e-09 ] [ -3.470090255925888e-11 -1.203785630760693e-09 1.944220981697716e-09 ] [ -1.424543298851904e-11 1.246821216319016e-09 -2.392887793444741e-09 ] [ -2.348105034281436e-09 -1.735292504033195e-09 3.075804042389071e-09 ] [ -1.179322636808346e-09 -9.469430999451763e-10 -5.268986928757575e-10 ] [ -5.126976241578684e-09 1.877869720865201e-09 -1.167806832128684e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.231235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.04248948309107e-18 } }