New benchmarks in the modelling of X-ray atomic form factors

Thorkildsen, G.

doi:10.1107/S2053273323003996

Acta Crystallographica Section A
Acta Crystallographica
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Figure 19
The mean absolute error $[\langle|\Delta f_{0}(s\semi Z)|\rangle_{s}]$ as a function of Z. Atomic form factors calculated by Kirkland. The * symbols are associated with model $[{\rm MB}[3({\rm L}+{\rm G})]]$ with parameters given by Kirkland. The other symbols are associated with model(s) $[{\rm MB}[(2,3){\rm L}+5{\rm G}+\alpha]]$ .

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ISSN: 2053-2733

Volume 79| Part 4| July 2023| Pages 318-330

https://doi.org/10.1107/S2053273323003996

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