{ "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" [ [ -0.9388178 1.2419754 1.2579151 ] [ 1.1343656 -1.0305919 -0.603535 ] [ 0.9345656 2.893259 -1.86516 ] [ 0.7717425 -0.5804381 -0.9971608 ] [ 0.3324285 1.2924004 0.4172784 ] [ -1.713413 -3.3163144 0.9808555 ] [ -2.3930498 -1.6533607 -0.4207348 ] [ 1.8721783 1.1530704 1.2305416 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.504151942743285e-09 1.989863965882804e-09 2.015402180775773e-09 ] [ 1.81745405873339e-09 -1.651190261369664e-09 -9.6696967480119e-10 ] [ 1.49733916726019e-09 4.635511965910205e-09 -2.988315770671439e-09 ] [ 1.236467800964745e-09 -9.299643613033551e-10 -1.597627734100747e-09 ] [ 5.32609175175669e-10 2.070653722652253e-09 6.685537023529055e-10 ] [ -2.745190272991842e-09 -5.313321442677729e-09 1.571503763430387e-09 ] [ -3.834088473558373e-09 -2.648975881113883e-09 -6.740914656706632e-10 ] [ 2.999560326941842e-09 1.847422452237034e-09 1.971544998684974e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.862352 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.745782241468316e-18 } }