{ "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" [ 5.33408 0 0 ] "si-unit" "m" "si-value" [ 5.33408e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.034982 5.4373 0 ] "si-unit" "m" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.179208 0.185424 5.40079 ] "si-unit" "m" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2520623 -0.3154622 0.2566729 ] [ -0.3499554 0.2190619 -1.1530519 ] [ 0.6863449 0.4036322 0.0088751 ] [ -2.0300671 2.5334329 -3.2801439 ] [ -0.3741763 0.254182 2.0173643 ] [ -0.6588535 0.5905358 -0.4041025 ] [ 1.2605435 -2.4270321 2.6963029 ] [ 0.2141017 -1.2583506 -0.1419169 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.006024944845076e-09 -5.054261615861338e-10 4.112353195729363e-10 ] [ -5.606903602027123e-10 3.509758546880275e-10 -1.84739279674902e-09 ] [ 1.099645752585314e-09 6.466900742420697e-10 1.421947772726208e-11 ] [ -3.252526046275256e-09 4.059006962745545e-09 -5.255369869439733e-09 ] [ -5.994965199174471e-10 4.072444578281857e-10 3.232173917096558e-09 ] [ -1.055599674232253e-09 9.461426525054248e-10 -6.47443577906832e-10 ] [ 2.019613325201405e-09 -3.888534088551128e-09 4.31995346897524e-09 ] [ 3.430287382135354e-10 -2.016099912089653e-09 -2.273759392764116e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.406292 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.832930989241808e-18 } }