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20022015
most citedX-ray Absorption Near-Edge Structure calculations with pseudopotentials. Application to K-edge in diamond and alpha-quartz

332 citations · 634 across the 8 of their papers we have counts for

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cond-mat2002★ 332 cited

X-ray Absorption Near-Edge Structure calculations with pseudopotentials. Application to K-edge in diamond and alpha-quartz

Mathieu Taillefumier, Delphine Cabaret, Anne-Marie Flank +1

We present a reciprocal-space pseudopotential scheme for calculating X-ray absorption near-edge structure (XANES) spectra. The scheme incorporates a recursive method to compute abs…