{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1395378 0.2572615 -0.5133469 ] [ 0.6446265 -0.9014587 -0.4874151 ] [ -0.9637475 0.9259444 0.6325907 ] [ -1.7410875 2.1557317 -1.3705984 ] [ -0.5641693 -0.3850341 -0.1491036 ] [ 2.0172438 -1.2414695 -0.5303709 ] [ 0.1413117 -0.8688078 1.3891315 ] [ 0.6053601 0.0578325 1.0291128 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.235642008778662e-10 4.121783607319392e-10 -8.224724015401556e-10 ] [ 1.032805507448131e-09 -1.444296053756761e-09 -7.80925077844894e-10 ] [ -1.544093712854448e-09 1.483526469840684e-09 1.013522030075506e-09 ] [ -2.78952968726712e-09 3.453862930457439e-09 -2.195940712985887e-09 ] [ -9.038988626331014e-10 -6.168926332307693e-10 -2.388903019971149e-10 ] [ 3.231980854813751e-09 -1.989053408336266e-09 -8.497478563326548e-10 ] [ 2.264063019855034e-10 -1.391983545128682e-09 2.225634012516835e-09 ] [ 9.6989379938515e-10 9.2657879422416e-11 1.648820468326026e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.33182 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.820999259511386e-18 } }