Experimental and theoretical charge-density analysis of 1,4-bis(5-hexyl-2-thienyl)butane-1,4-dione: applications of a virtual-atom model

Ahmed, M.; Nassour, A.; Noureen, S.; Lecomte, C.; Jelsch, C.

doi:10.1107/S2052520615019083

Acta Crystallographica Section B
Acta Crystallographica
Section B STRUCTURAL SCIENCE, CRYSTAL ENGINEERING AND MATERIALS

IUCr IT WDC

home archive editors for authors for readers submit subscribe open access

view article

Figure 5
Fourier residual map for the THEO_VIR refinements: (a) without and (b) with kappa core correction. Resolution used: s <1.2 Å⁻¹. Contours as in Fig. 3

STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS

ISSN: 2052-5206

Volume 72| Part 1| January 2016| Pages 75-86

doi:10.1107/S2052520615019083

Follow Acta Cryst. B

Search IUCr Journals		doi		Advanced search
Author		volume	page