{ "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" [ 5.35419 0 0 ] "si-unit" "m" "si-value" [ 5.35419e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.128546 5.3923 0 ] "si-unit" "m" "si-value" [ 1.28546e-11 5.3923e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0752915 -0.0875116 5.49588 ] "si-unit" "m" "si-value" [ 7.52915e-12 -8.75116e-12 5.495879999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00225511 0.0160353 -0.067451 ] [ 1.37153 1.32836 1.3623 ] [ 0.0305896 2.71279 2.89841 ] [ 1.38735 4.02786 4.05412 ] [ 2.7178 -0.0621827 2.7228 ] [ 3.99586 1.31169 4.14487 ] [ 2.78113 2.65016 0.11239 ] [ 4.13075 3.95144 1.3393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.25511e-13 1.60353e-12 -6.7451e-12 ] [ 1.37153e-10 1.32836e-10 1.3623e-10 ] [ 3.05896e-12 2.71279e-10 2.89841e-10 ] [ 1.38735e-10 4.027860000000001e-10 4.05412e-10 ] [ 2.7178e-10 -6.21827e-12 2.7228e-10 ] [ 3.99586e-10 1.31169e-10 4.14487e-10 ] [ 2.78113e-10 2.65016e-10 1.1239e-11 ] [ 4.13075e-10 3.95144e-10 1.3393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4485846999999996 0.5624130999999998 1.4545482999999995 ] [ -0.6634515999999998 -0.023795499999999994 1.1324719999999995 ] [ -0.3032012999999999 -1.6591022999999996 -2.5057975999999993 ] [ 3.258134699999999 -0.9058828999999997 1.5172996999999995 ] [ -0.7549756999999998 0.2269860999999999 -0.07075659999999998 ] [ 1.3304392999999997 -1.0759705999999996 -0.4049053999999999 ] [ -2.690112699999999 1.4117377999999996 -1.7738038999999994 ] [ 1.2717519999999995 1.4636143999999995 0.6509434999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.320888539588581e-09 9.010851200516522e-10 2.330443280084384e-09 ] [ -1.062966642552353e-09 -3.812459378024639e-11 1.814420162110617e-09 ] [ -4.857820342561668e-10 -2.658174916575508e-09 -4.014730331176749e-09 ] [ 5.220107243757221e-09 -1.451384403562504e-09 2.430982106086853e-09 ] [ -1.209604415812114e-09 3.636718226665708e-10 -1.133645702872972e-10 ] [ 2.131598741853517e-09 -1.723894939988148e-09 -6.487299655156722e-10 ] [ -4.310035675257163e-09 2.261853297859626e-09 -2.84194713846386e-09 ] [ 2.037571321855641e-09 2.344968773546219e-09 1.042926457161725e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.093773 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.782859925706228e-18 } }