{ "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" [ [ -1.8770157 0.1068598 -0.0229921 ] [ 0.0260469 -0.4287264 0.5324853 ] [ -1.1216777 0.7755005 -0.5714829 ] [ 1.4506629 1.0539183 -1.8251316 ] [ -0.7024831 -0.772117 1.8653544 ] [ 0.6969718 -0.8133786 -0.2622409 ] [ -0.5639289 -0.2865598 -0.499799 ] [ 2.0914236 0.3645032 0.7838068 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.007310671414547e-09 1.712082732633638e-10 -3.683740508309568e-11 ] [ 4.173173422431552e-11 -6.868954147997491e-10 8.531354985796743e-10 ] [ -1.797125787012716e-09 1.242488770518711e-09 -9.156165415669844e-10 ] [ 2.324218183041928e-09 1.688563260493281e-09 -2.924183179403297e-09 ] [ -1.125501999327109e-09 -1.237067805922234e-09 2.988627209186412e-09 ] [ 1.116671923316893e-09 -1.303176176779035e-09 -4.201562389975507e-10 ] [ -9.03513699373461e-10 -4.591194120211238e-10 -8.007662728992193e-10 ] [ 3.350829996109371e-09 5.839985052467866e-10 1.255796930184061e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.835886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.498494604365402e-18 } }