Neutron diffraction of hydrogenous materials: measuring incoherent and coherent intensities separately from liquid water - a 40-year-old puzzle solved

Abstract

(short version) Accurate determination of the coherent static structure factor of disordered materials containing proton nuclei is prohibitively difficult by neutron diffraction, due to the large incoherent cross section of ${}^1$H. This notorious problem has set severe obstacles to the structure determination of hydrogenous materials up to now, via introducing large uncertainties into neutron diffraction data processing. Here we present the first accurate separate measurements, using polarized neutron diffraction, of the coherent and incoherent contributions to the total static structure factor of 5 mixtures of light and heavy water, over an unprecedentedly wide momentum transfer range. The structure factors of H${}_2$O and D${}_2$O mixtures derived in this work may signify the beginning of a new era in the structure determination of hydrogenous materials, using neutron diffraction.

8 pages

Cited by in corpus (3)

• Reverse Monte Carlo modeling of liquid water with the explicit use of the SPC/E interatomic potential
• Tuning from Frustrated Magnetism to Superconductivity in Quasi-One-Dimensional KCr${}_3$As${}_3$ Through Hydrogen Doping
• Structural studies of ${}^1$H-containing liquids by polarized neutrons: chemical environment and wavelength dependence of the incoherent background