{ "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" [ 5.4484 0 0 ] "si-unit" "m" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00476084 5.4399 0 ] "si-unit" "m" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0697031 -0.0639637 5.39979 ] "si-unit" "m" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00902537 -0.0303023 -0.0491559 ] [ 1.28054 1.44048 1.35481 ] [ -0.0535965 2.57981 2.82719 ] [ 1.28029 4.0563 4.12138 ] [ 2.62772 -0.0777145 2.68834 ] [ 4.08246 1.48548 4.03991 ] [ 2.84369 2.84518 0.0189163 ] [ 4.03071 4.03913 1.36727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.02537e-13 -3.03023e-12 -4.91559e-12 ] [ 1.28054e-10 1.44048e-10 1.35481e-10 ] [ -5.35965e-12 2.57981e-10 2.82719e-10 ] [ 1.28029e-10 4.0563e-10 4.12138e-10 ] [ 2.62772e-10 -7.771450000000001e-12 2.68834e-10 ] [ 4.08246e-10 1.48548e-10 4.03991e-10 ] [ 2.84369e-10 2.84518e-10 1.89163e-12 ] [ 4.03071e-10 4.03913e-10 1.36727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0585472 2.2040628 1.9591596 ] [ 1.8642267 -2.3999517 -0.4395851 ] [ 1.2803063 4.8651788 -3.1339964 ] [ 1.3450259 -0.9057996 -1.3728344 ] [ 0.2670707 2.4019256 0.3996118 ] [ -2.3999074 -5.5440365 1.5029241 ] [ -3.6306614 -1.8287906 -0.251695 ] [ 2.3324864 1.2074111 1.3364155 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.695979575853302e-09 3.531297888934986e-09 3.13891970753588e-09 ] [ 2.986820434611136e-09 -3.845146504789216e-09 -7.042929700720301e-10 ] [ 2.051276821322951e-09 7.794875729371799e-09 -5.021215761751365e-09 ] [ 2.154969051350479e-09 -1.451250942249992e-09 -2.199523179909996e-09 ] [ 4.278944316406906e-10 3.848309041221013e-09 6.402486833558055e-10 ] [ -3.845075528364914e-09 -8.88252566516186e-09 2.407949855856881e-09 ] [ -5.816960813120998e-09 -2.930045543658805e-09 -4.03259844572256e-10 ] [ 3.737055178413957e-09 1.934485836114411e-09 2.141173669774743e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.24071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.646184166239277e-18 } }