{ "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" [ [ -4.9929903 1.1680112 0.9198774 ] [ 0.0263625 -0.2188809 0.6753577 ] [ -2.3847503 1.5187819 -1.677831 ] [ 3.8054518 1.0313272 -4.0132225 ] [ -1.7286528 -0.8404373 4.273355 ] [ 1.2378472 -2.0072807 -0.1210924 ] [ -1.8805565 -1.4888921 -1.6586762 ] [ 5.9172884 0.8373708 1.602232 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.999652392448649e-09 1.871360252890301e-09 1.473806076424671e-09 ] [ 4.2237381513825e-11 -3.506858636088906e-10 1.082042326531982e-09 ] [ -3.820791208584489e-09 2.433356872322124e-09 -2.688181624000854e-09 ] [ 6.097005955773241e-09 1.652368341848645e-09 -6.429891316543065e-09 ] [ -2.769607124458675e-09 -1.346529004402048e-09 6.846669529787069e-09 ] [ 1.983249860302325e-09 -3.216018235419163e-09 -1.940114138349816e-10 ] [ -3.012983683216821e-09 -2.385468133167191e-09 -2.65749225101191e-09 ] [ 9.480541211119245e-09 1.341615929753887e-09 2.567058672647088e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.116842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.626338371226982e-18 } }