{ "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" [ [ 1.8107011 -0.4238762 -0.2393479 ] [ -0.4292782 0.3176932 -0.1263697 ] [ 1.5138237 -0.7372741 0.4478105 ] [ -1.2849373 -0.6432165 1.3942899 ] [ 0.775711 0.0910467 -1.7248424 ] [ -0.7546797 0.9183764 0.6056827 ] [ 0.6675923 0.3259713 0.1814092 ] [ -2.298933 0.1512792 -0.5386322 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.901062993578097e-09 -6.791245433487107e-10 -3.834776127769686e-10 ] [ -6.877795015255787e-10 5.090006218206888e-10 -2.024665805855898e-10 ] [ 2.425412960135425e-09 -1.181243335873379e-09 7.174715195598569e-10 ] [ -2.058696518215048e-09 -1.030546446903261e-09 2.233898698802196e-09 ] [ 1.242826038936774e-09 1.458728953428078e-10 -2.763502190612482e-09 ] [ -1.20913018149413e-09 1.471401209297037e-09 9.704106695580317e-10 ] [ 1.069600784098318e-09 5.222636002146042e-10 2.906495814326327e-10 ] [ -3.683296735731522e-09 2.423759994502128e-10 -8.629839251600147e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -0.47620360156248154 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.629622834500538e-20 } }