The energy resolution associated with a particular Bragg reflection is limited by the diffraction properties and by the quality of the material. It can be derived from the structure factor within the dynamic theory of diffraction for ideal crystals. Using the GaAs [200] reflection on a neutron backscattering spectrometer we could realize a resolution of AE=(43±5) neV. This is an improvement by ...

Pressure effects on the stability of magnetic phases in La(1.4)Sr(1.6)Mn(2)O(7) have been studied using magnetization measurements and neutron diffraction. At ambient conditions this material is a quasi-two-dimensional ferromagnet. On cooling it becomes ordered three dimensionally: at 90 K La(1.4)Sr(1.6)Mn(2)O(7) it becomes an antiferromagnet, and at 65 K it undergoes a transition into a ferrom...

First principles calculations on the hybrid perovskite CH3NH3PbI3 predict strong hydrogen-bonding which influences the structure and dynamics of the methylammonium cation and reveal its interaction with the tilting of the PbI6 octahedra. The calculated atomic coordinates are in excellent agreement with neutron diffraction results.

We report muon spin relaxation (μSR) measurements on two Ti(3+) containing perovskites, LaTiO(3) and YTiO(3), which display long-range magnetic order at low temperature. For both materials, oscillations in the time dependence of the muon polarization are observed which are consistent with three-dimensional magnetic order. From our data we identify two magnetically inequivalent muon stopping sit...

In this paper we present a neutron diffraction in situ study of the thermal evolution and high-temperature structure of layered cobaltites Y (Ba, Sr)Co(2)O(5 + δ). Neutron thermodiffractograms and magnetic susceptibility measurements are reported in the temperature range 20 K ≤ T ≤ 570 K, as well as high-resolution neutron diffraction experiments at selected temperatures. Starting from the as-s...

The properties of some forms of water ice reserve still intriguing surprises. Besides the several stable or metastable phases of pure ice, solid mixtures of water with gases are precursors of other ices, as in some cases they may be emptied, leaving a metastable hydrogen-bound water structure. We present here the first characterization of a new form of ice, obtained from the crystalline solid c...

The lipid matrix present in the uppermost layer of the skin, the stratum corneum, plays a crucial role in the skin barrier function. The lipids are organized into two lamellar phases. To gain more insight into the molecular organization of one of these lamellar phases, we performed neutron diffraction studies. In the diffraction pattern, five diffraction orders were observed attributed to a lam...

Some of the improvements in SHELX2013 make SHELXL convenient to use for refinement of macromolecular structures against neutron data without the support of X-ray data. The new NEUT instruction adjusts the behaviour of the SFAC instruction as well as the default bond lengths of the AFIX instructions. This work presents a protocol on how to use SHELXL for refinement of protein structures against ...

Motifs of periodic modulations are encountered in a variety of natural systems, where at least two rival states are present. In strongly correlated electron systems, such behaviour has typically been associated with competition between short- and long-range interactions, for example, between exchange and dipole-dipole interactions in the case of ferromagnetic thin films. Here we show that spin-...

The D2 clathrate hydrate crystal structure was determined as a function of temperature and pressure by neutron diffraction for the first time. The hydrogen occupancy in the (32+X)H2.136H(2)O, x=0-16 clathrate can be reversibly varied by changing the large (hexakaidecahedral) cage occupancy between two and four molecules, while remaining single occupancy of the small (dodecahedral) cage. Above 1...