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- W2007127958 abstract "Absolute photoionization cross section profiles and asymmetry parameters of Ne, Ar and Kr have been calculated at the time-dependent local density approximation level. We employed a very accurate B-spline finite basis set and the modified Sternheimer approach, which is a first-order perturbative scheme particularly suited to finite basis set calculations. The gradient-dependent van Leeuwen and Baerends (VLB) exchange-correlation potential has been used, since it has the correct Coulombic behaviour at large distances which is a necessary condition for the existence of the Rydberg states. A simple modification of the boundary conditions considerably improves the number of terms of the Rydberg series. The resonance parameters obtained by fitting the calculated Fano profiles with a suitable analytic expression are compared with the experimental parameters." @default.
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- W2007127958 date "1995-12-14" @default.
- W2007127958 modified "2023-10-16" @default.
- W2007127958 title "Density functional-time-dependent local density approximation calculations of autoionization resonances in noble gases" @default.
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- W2007127958 doi "https://doi.org/10.1088/0953-4075/28/23/009" @default.
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