{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.448400000000001e-10 0.0 0.0 ] "source-value" [ 5.4484 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.76084e-13 5.4399e-10 0.0 ] "source-value" [ 0.00476084 5.4399 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.970310000000001e-12 -6.39637e-12 5.39979e-10 ] "source-value" [ -0.0697031 -0.0639637 5.39979 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.056217934021498e-09 2.469898175117775e-09 2.53294030035769e-09 ] [ 2.030863328779676e-09 -2.03971567504492e-09 -1.137053372327752e-09 ] [ 3.402367371688306e-09 7.057141327782121e-09 -4.889153790299332e-09 ] [ 1.590230151044667e-09 -1.661646693263841e-09 -2.030565484145869e-09 ] [ 3.746523401372237e-10 2.333287944674615e-09 6.389288102555904e-10 ] [ -4.68749582992234e-09 -7.388557810283421e-09 3.696540777986126e-09 ] [ -4.847933150417052e-09 -3.275250037723386e-09 -1.685779638832303e-09 ] [ 4.193533722711016e-09 2.504842768741058e-09 2.874142397005851e-09 ] ] "source-value" [ [ -1.2833903 1.5415892 1.580937 ] [ 1.2675652 -1.2730904 -0.7096929 ] [ 2.1235907 4.4047212 -3.0515698 ] [ 0.9925436 -1.0371183 -1.2673793 ] [ 0.2338396 1.4563238 0.398788 ] [ -2.9257048 -4.6115751 2.3071993 ] [ -3.0258419 -2.0442503 -1.0521809 ] [ 2.6173979 1.5633999 1.7938986 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.693861577903381e-18 "source-value" -35.538289 } }