{ "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" [ 5.4484 0 0 ] "si-unit" "m" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00476084 5.4399 0 ] "si-unit" "m" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0697031 -0.0639637 5.39979 ] "si-unit" "m" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00902537 -0.0303023 -0.0491559 ] [ 1.28054 1.44048 1.35481 ] [ -0.0535965 2.57981 2.82719 ] [ 1.28029 4.0563 4.12138 ] [ 2.62772 -0.0777145 2.68834 ] [ 4.08246 1.48548 4.03991 ] [ 2.84369 2.84518 0.0189163 ] [ 4.03071 4.03913 1.36727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.02537e-13 -3.03023e-12 -4.91559e-12 ] [ 1.28054e-10 1.44048e-10 1.35481e-10 ] [ -5.35965e-12 2.57981e-10 2.82719e-10 ] [ 1.28029e-10 4.0563e-10 4.12138e-10 ] [ 2.62772e-10 -7.771450000000001e-12 2.68834e-10 ] [ 4.08246e-10 1.48548e-10 4.03991e-10 ] [ 2.84369e-10 2.84518e-10 1.89163e-12 ] [ 4.03071e-10 4.03913e-10 1.36727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.821753 1.1707965 1.2739083 ] [ 1.1068119 -1.2620143 -0.5188782 ] [ 1.5690482 3.2786963 -2.4082732 ] [ 0.8137061 -0.3410195 -0.884064 ] [ 0.2191074 1.2286601 0.2280986 ] [ -2.2253544 -3.744294 1.4988802 ] [ -2.4279046 -1.7066045 -0.5312795 ] [ 1.7663384 1.3757794 1.3416078 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.316593444672262e-09 1.875822780014467e-09 2.041026095303073e-09 ] [ 1.773308149803228e-09 -2.021969806575277e-09 -8.313345210827865e-10 ] [ 2.513892342948322e-09 5.253050558563463e-09 -3.858479017539203e-09 ] [ 1.303700889622347e-09 -5.463734701369056e-10 -1.416426672090931e-09 ] [ 3.51048753724274e-10 1.96853048712979e-09 3.654542441572109e-10 ] [ -3.565410792674411e-09 -5.999020308201715e-09 2.401470813820029e-09 ] [ -3.889931987652776e-09 -2.734281830852074e-09 -8.512035940103136e-10 ] [ 2.829986088901279e-09 2.204241590058252e-09 2.149492651442922e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.588969 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.701981409017596e-18 } }