{ "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" [ [ -0.7908413 1.1724833 0.9868169 ] [ 0.9794112 -0.8404256 -0.4839438 ] [ 1.3177354 2.5613645 -2.0287352 ] [ 0.6871808 -0.6102527 -0.7874126 ] [ 0.2060312 1.2118059 0.3267963 ] [ -1.9694771 -3.0793284 1.3170851 ] [ -2.0892122 -1.4019249 -0.5793995 ] [ 1.659172 0.986278 1.2487927 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.267067441623079e-09 1.878525331538432e-09 1.581054966190332e-09 ] [ 1.569189726789673e-09 -1.346510247841812e-09 -7.75363442141111e-10 ] [ 2.111244850280536e-09 4.103758319247081e-09 -3.250392107234012e-09 ] [ 1.100985012022641e-09 -9.77732608720076e-10 -1.261574058643342e-09 ] [ 3.30098371795369e-10 1.941527081927503e-09 5.23585391623943e-10 ] [ -3.155450164820983e-09 -4.933627970245472e-09 2.11020295482403e-09 ] [ -3.347286942730134e-09 -2.246131298897378e-09 -9.283003330032095e-10 ] [ 2.658286588285978e-09 1.580191553209382e-09 2.000786468165708e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.008145240654237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.725005266774701e-18 } }