 | Acta Crystallographica Section A Acta Crystallographica Section A FOUNDATIONS AND ADVANCES |
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![[Figure 2]](pl5022fig2mag.jpg)
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Figure 2
Raw Fourier synthesis [equation (3) ![[link]](../../../../../../logos/arrows/a_arr.gif){kind=small} ] of the ED distribution for CaB6 at [sin(θ)/λ]max = 1.5 Å−1 shown in the (200) and (110) planes. (a) Synthesized all-ED Sn,tot(r) with spurious NNMs and large regions with negative values (red isolines). (b) All-ED ![[S_{n,{\rm val}}^\circ ({\bf{r}} )]](teximages/pl5022fi51.svg){kind=small} from val-ED synthesis Sn,val(r) [equation (19)] with spurious NNMs, the most prominent ones shown by red arrows; black isoline steps of 0.0078 e− bohr−3. |
![[Figure 2]](pl5022fig2.jpg)
| FOUNDATIONS ADVANCES |
ISSN: 2053-2733
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