{ "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" [ 5.11534 0 0 ] "si-unit" "m" "si-value" [ 5.11534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.215947 5.44617 0 ] "si-unit" "m" "si-value" [ -2.15947e-11 5.446170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.311017 -0.240161 5.43903 ] "si-unit" "m" "si-value" [ 3.11017e-11 -2.40161e-11 5.43903e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.11262 0.0410701 -0.0158461 ] [ 1.41877 1.4243 1.25044 ] [ 0.19719 2.45185 3.01922 ] [ 1.59796 4.1675 4.07229 ] [ 3.2205 -0.170535 2.05026 ] [ 3.94627 1.40202 3.6633 ] [ 2.60901 3.00439 -0.668036 ] [ 3.72698 4.31381 0.563179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1262e-11 4.10701e-12 -1.58461e-12 ] [ 1.41877e-10 1.4243e-10 1.25044e-10 ] [ 1.9719e-11 2.45185e-10 3.01922e-10 ] [ 1.59796e-10 4.1675e-10 4.07229e-10 ] [ 3.2205e-10 -1.70535e-11 2.05026e-10 ] [ 3.94627e-10 1.40202e-10 3.6633e-10 ] [ 2.60901e-10 3.00439e-10 -6.68036e-11 ] [ 3.726980000000001e-10 4.31381e-10 5.63179e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.538767700000001 8.918417400000001 -4.453888700000001 ] [ 1.4695341000000002 0.5319172000000001 0.15403510000000004 ] [ 8.742600900000001 7.141191300000002 -5.271076700000001 ] [ -1.2481339000000002 0.2734858 -5.270041600000001 ] [ -5.4123711000000005 3.533252900000001 5.640459700000001 ] [ -3.281073500000001 -10.215555400000001 1.6597100000000005 ] [ -3.855616700000001 -2.0596935000000003 4.342895500000001 ] [ -1.9537075000000004 -8.123015700000002 3.1979067000000008 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.874084190093924e-09 1.428887997053903e-08 -7.135916405576637e-09 ] [ 2.35445319788622e-09 8.522253090627049e-10 2.467914380358534e-10 ] [ 1.400719088236737e-08 1.144144983978409e-08 -8.445195924761829e-09 ] [ -1.999730970683293e-09 4.381725584907972e-10 -8.443537511727974e-09 ] [ -8.671574510956877e-09 5.660895238392739e-09 9.03701273635865e-09 ] [ -5.2568592961366e-09 -1.636712416521252e-08 2.659148581216141e-09 ] [ -6.177378986400189e-09 -3.299992798901679e-09 6.958085694003747e-09 ] [ -3.130184506170555e-09 -1.301450595215515e-08 5.123611392452048e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.409041 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.070977178254799e-18 } }