{ "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" [ [ -1.1627747 1.7254236 1.5502904 ] [ 1.4279042 -1.5204005 -0.6164617 ] [ 1.8340491 4.2450579 -3.0005367 ] [ 1.0797693 -0.9255802 -1.1901439 ] [ 0.1909568 1.7214234 0.373942 ] [ -2.7121757 -4.7338404 1.9631093 ] [ -3.1234735 -1.8753836 -0.7459996 ] [ 2.4657445 1.3632999 1.6658002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.862970454946359e-09 2.764433375672162e-09 2.483839054794513e-09 ] [ 2.287754744830463e-09 -2.435950155421917e-09 -9.876805314959176e-10 ] [ 2.938470613628729e-09 6.801332577357108e-09 -4.807389790199467e-09 ] [ 1.729981142570536e-09 -1.482942969333047e-09 -1.906820747677633e-09 ] [ 3.059465230634112e-10 2.758024348700835e-09 5.991211348712279e-10 ] [ -4.345384533842594e-09 -7.584448477965213e-09 3.145247850448096e-09 ] [ -5.004356258618198e-09 -3.004695783706802e-09 -1.195223128093346e-09 ] [ 3.950558223314013e-09 2.184247244914536e-09 2.668906157352526e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.497316 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.687297026491433e-18 } }