{ "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" [ 5.51626 0 0 ] "si-unit" "m" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0156708 5.55287 0 ] "si-unit" "m" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0707378 -0.0779479 5.31818 ] "si-unit" "m" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3274685 0.3157705 -0.0393744 ] [ -0.1629951 -0.5591345 0.8929516 ] [ -0.7078939 0.6339623 -0.2168298 ] [ 1.1043886 0.1952937 -1.6564565 ] [ -0.1359372 -0.0965703 1.6458852 ] [ 0.7203086 -1.0898296 -0.5478276 ] [ -0.6817569 -0.4051352 -0.8404975 ] [ 2.1913544 1.0056431 0.762149 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.729015616348445e-09 5.059201126383264e-10 -6.308474313802751e-11 ] [ -2.611469385249581e-10 -8.958322237826975e-10 1.430666177025953e-09 ] [ -1.134171056586933e-09 1.015719575528596e-09 -3.473996362527398e-10 ] [ 1.769425595198043e-09 3.12895000329529e-10 -2.653935877672195e-09 ] [ -2.177954037370138e-10 -1.547226769236422e-10 2.636998787960732e-09 ] [ 1.154061598681179e-09 -1.746099505775816e-09 -8.777165729489741e-10 ] [ -1.092294966249084e-09 -6.490981457031321e-10 -1.346625444340848e-09 ] [ 3.510936787567212e-09 1.611217863688836e-09 1.221097309366099e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.469382 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.522603797382435e-18 } }