{ "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" [ 5.42386 0 0 ] "si-unit" "m" "si-value" [ 5.423860000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00583756 5.42008 0 ] "si-unit" "m" "si-value" [ -5.83756e-13 5.42008e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.133978 0.025245 5.31918 ] "si-unit" "m" "si-value" [ 1.33978e-11 2.5245e-12 5.31918e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0601366 -0.000139309 -0.0552929 ] [ 1.41186 1.40158 1.29827 ] [ 0.0312084 2.71899 2.71348 ] [ 1.40738 4.08238 4.03102 ] [ 2.73873 -0.00499376 2.66143 ] [ 4.093 1.3473 4.02214 ] [ 2.75009 2.74892 -0.00923085 ] [ 4.15824 4.1992 1.24093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.01366e-12 -1.39309e-14 -5.52929e-12 ] [ 1.41186e-10 1.40158e-10 1.29827e-10 ] [ 3.12084e-12 2.71899e-10 2.71348e-10 ] [ 1.40738e-10 4.08238e-10 4.03102e-10 ] [ 2.73873e-10 -4.993760000000001e-13 2.66143e-10 ] [ 4.093e-10 1.3473e-10 4.02214e-10 ] [ 2.75009e-10 2.74892e-10 -9.23085e-13 ] [ 4.158240000000001e-10 4.1992e-10 1.24093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8148056000000004 1.8124927000000004 0.007835600000000002 ] [ -0.7398240000000001 -0.4689003000000001 0.5190029000000002 ] [ 0.23778710000000006 0.4276298000000001 -1.0146480000000002 ] [ 0.4100467000000001 -0.4894507000000001 -0.7663412000000002 ] [ 0.15410310000000002 0.6918493000000001 -0.3976999000000001 ] [ 0.3763339000000001 0.12715000000000004 -0.8848499000000002 ] [ -0.5656464000000001 0.4723983000000001 0.31902780000000003 ] [ -1.6876059000000005 -2.5731691000000003 2.2176726000000007 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.907639103616917e-09 2.903933429310669e-09 1.255401512994048e-11 ] [ -1.185328716306739e-09 -7.512610981461064e-10 8.315343125074005e-10 ] [ 3.809769323478317e-10 6.851384679173801e-10 -1.625645303941479e-09 ] [ 6.569672361761915e-10 -7.841864685741947e-10 -1.227813954195817e-09 ] [ 2.469003840128045e-10 1.108464773576846e-09 -6.371854818744981e-10 ] [ 6.029533761944853e-10 2.037167573347201e-10 -1.417685822697218e-09 ] [ -9.062654377196853e-10 7.568655119656648e-10 5.111388825452582e-10 ] [ -2.703842718104144e-09 -4.122671373384978e-09 3.553103192308751e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.19703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.799403520839623e-18 } }