{ "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" [ [ -0.9665425 1.2547785 1.3102303 ] [ 1.1308125 -1.0188052 -0.5415353 ] [ 1.6276962 3.4518034 -2.5054267 ] [ 0.8496866 -0.7166385 -1.0559502 ] [ 0.2578532 1.2556856 0.3954357 ] [ -2.3958585 -3.76145 1.6929509 ] [ -2.5972339 -1.8196136 -0.7699043 ] [ 2.0935864 1.3542397 1.4741995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.548571796509584e-09 2.010376776982493e-09 2.09922035452377e-09 ] [ 1.8117613500084e-09 -1.632305872589468e-09 -8.676351969979143e-10 ] [ 2.607856797405001e-09 5.530398707077951e-09 -4.014136083868096e-09 ] [ 1.361348005527041e-09 -1.148181450265181e-09 -1.691818723169084e-09 ] [ 4.131263686384666e-10 2.01183011139522e-09 6.335578335696826e-10 ] [ -3.838588475444957e-09 -6.02650725030816e-09 2.712406352142319e-09 ] [ -4.161227433329205e-09 -2.915342368809723e-09 -1.23352266971339e-09 ] [ 3.354295183704837e-09 2.169731186299205e-09 2.36192797329505e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.785796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.733516570791816e-18 } }