Jan Šaroun

Monochromator and analyzer systems that rely on bent single crystals are in use throughout the neutron scattering community. An adequate component for the simulation of such crystals was missing in the widely used neutron simulation software package McStas. The newly developed component Monochromator_bent, which fills this gap, is introduced. It can serve as a model for crystal monochromators and analyzers of various kinds, including the bent perfect crystals, mosaic crystals, and crystals combining mosaicity with bending. The performance of the component is tested at several configurations and compared with the results of another simulation program, SIMRES. Validation is carried out using analytical calculations and the McStas NCrystal_sample component for the case of unbent crystals. Excellent agreement in all tests and good performance in terms of computing speed has been found. The component has been included in the present distribution of McStas 3.5.

The impact of manufacturing strategies on the development of residual stresses in Dievar steel is presented. Two fabrication methods were investigated: conventional ingot casting and selective laser melting as an additive manufacturing process. Subsequently, plastic deformation in the form of hot rotary swaging at 900 °C was applied. Residual stresses were measured using neutron diffraction. Microstructural and phase analysis, precipitate characterization, and hardness measurement—carried out to complement the investigation—showed the microstructure improvement by rotary swaging. The study reveals that the manufacturing method has a significant effect on the distribution of residual stresses in the bars. The results showed that conventional ingot casting resulted in low levels of residual stresses (up to ±200 MPa), with an increase in hardness after rotary swaging from 172 HV1 to 613 HV1. SLM-manufactured bars developed tensile hoop and axial residual stresses in the vicinity of the surface and large compressive axial stresses (−600 MPa) in the core due to rapid cooling. The subsequent thermomechanical treatment via rotary swaging effectively reduced both the surface tensile (to approximately +200 MPa) and the core compressive residual stresses (to −300 MPa). Moreover, it resulted in a predominantly hydrostatic stress character and a reduction in von Mises stresses, offering relatively favorable residual stress characteristics and, therefore, a reduction in the risk of material failure. In addition to the significantly improved stress profile, rotary swaging contributed to a fine grain (3–5 µm instead of 10–15 µm for the conventional sample) and increased the hardness of the SLM samples from 560 HV1 to 606 HV1. These insights confirm the utility of rotary swaging as a post-processing technique that not only reduces residual stresses but also improves the microstructural and mechanical properties of additively manufactured components.

Rotary swaging is a promising technique for the fabrication of clad Cu/Al composites. Residual stresses appearing during the processing of a special arrangement of Al filaments within the Cu matrix and the influence of the bar reversal between the passes were studied by (i) neutron diffraction using a novel evaluation procedure for pseudo-strain correction and (ii) a finite element method simulation. The initial study of the stress differences in the Cu phase allowed us to infer that the stresses around the central Al filament are hydrostatic when the sample is reversed during the passes. This fact enabled the calculation of the stress-free reference and, consequently, the analysis of the hydrostatic and deviatoric components. Finally, the stresses with the von Mises relation were calculated. Hydrostatic stresses (far from the filaments) and axial deviatoric stresses are zero or compressive for both reversed and non-reversed samples. The reversal of the bar direction slightly changes the overall state within the region of high density of Al filaments, where hydrostatic stresses tend to be tensile, but it seems to be advantageous for avoiding plastification in the regions without Al wires. The finite element analysis revealed the presence of shear stresses; nevertheless, stresses calculated with the von Mises relation show similar trends in the simulation and in the neutron measurements. Microstresses are suggested as a possible reason for the large width of the neutron diffraction peak in the measurement of the radial direction.

Focusing 3-axis diffractometer set-up equipped with bent perfect crystal (BPC) monochromator and analyzer offers the sensitivity in determination of strains Dd/d < 10^-4 in polycrystalline materials which is about one order of magnitude higher with respect to that of conventional 2-axis neutron scanners. It also offers possibility of line profile analysis for reasonable sample volumes and counting times. In this paper, the feasibility of using the 3-axis set-up even for measurements of rather large bulk polycrystalline samples with an acceptable resolution is presented. As the 3-axis set-up exploits focusing in real and momentum space, by a proper adjustment of the curvature of the analyzer, a high-resolution determination of the lattice changes can also be achieved even on large irradiated gauge volumes, though with a slightly relaxed resolution. It can be successfully exploited namely, in the strain/stress measurements on samples exposed to an external load, e.g. in tension/compression rig, in aging machine etc. In addition to the original performance where the analysis is carried out by rocking the BPC analyzer and the neutron signal registered by a point detector, a new alternative is offered which uses a fixed rocking angle position of the analyzer and the detector signal is registered by a one-dimensional position sensitive detector (PSD). This trick makes possible in some cases the elastic strain/stress measurements considerably faster and thus reduces the drawback of the time consuming step-by-step analysis.

Experimental analyses of depth distributions of phase-specific residual stresses after deep rolling were carried out by means of laboratory X-ray diffraction and neutron diffraction for the two duplex steels X2CrNiMoN22-5-3 and X3CrNiMoN27-5-2, which differ significantly in their ferrite to austenite ratios. The aim of the investigation was to elucidate to which extent comparable results can be achieved with the destructive and the non-destructive approach and how the process induced phase-specific micro residual stresses influence the determination of the phase- and {hkl}-specific reference value d₀, required for evaluation of neutron strain scanning experiments. A further focus of the work was the applicability of correction approaches that were developed originally for single-phase materials for accounting for spurious strains during through surface neutron scanning experiments on coarse two-phase materials. The depth distributions of macro residual stresses were separated from the phase-specific micro residual stresses. In this regard, complementary residual stress analysis was carried out by means of incremental hole drilling. The results indicate that meaningful macro residual stress depth distributions can be determined non-destructively by means of neutron diffraction for depths starting at about 150–200 µm. Furthermore, it was shown that the correction of the instrumental surface effects, which are intrinsic for surface neutron strain scanning, through neutron ray-tracing simulation is applicable to multiphase materials and yields reliable results. However, phase-specific micro residual stresses determined by means of neutron diffraction show significant deviations to data determined by means of lab X-ray stress analysis according to the well-known sin²ψ-method.

Resolution properties of the unconventional high-resolution neutron diffraction three-axis setup for strain/stress measurements of large bulk polycrystalline samples are presented. Contrary to the conventional two-axis setups, in this case, the strain measurement on a sample situated on the second axis is carried out by rocking the bent perfect crystal (BPC) analyzer situated on the third axis of the diffractometer. Thus, the so-called rocking curve provides the sample diffraction profile. The neutron signal coming from the analyzer is registered by a point detector. This new setup provides a considerably higher resolution (at least by a factor of 5), which however, requires a much longer measurement time. The high-resolution neutron diffraction setting can be effectively used, namely, for bulk gauge volumes up to several cubic centimeters, and for plastic deformation studies on the basis of the analysis of diffraction line profiles, thus providing average values of microstructure characteristics over the irradiated gauge volume.

Arc welding generally introduces undesired local residual stress states on engineering components hindering high-quality performance in service. Common procedures to reduce the tensile residual stresses are post-heat treatments or mechanical surface treatments like hammering or shot-peening. Assessments of residual stress profiles of post-weld treatments underneath the weld surface are essential, especially in high safety exigency systems like pressure vessels or piping at power plants. In this study, neutron diffraction is used to determine the stress profile after finish milling of an austenitic steel weld in order to verify a chained finite element simulation predicting the final residual stress fields including milling and welding contributions. Non-destructive measurements with spatial resolutions of less than 0.2 mm within the first 1 mm from the surface were mandatory to confirm the finite element simulations of the coarse-grained austenitic material. In the data analysis procedure, the obtained near-surface data have been corrected for spurious strain effects whenever the gauge volume was partially immersed in the sample. Moreover, constraining the surface data to values obtained by x-ray diffraction and data deconvolution within the gauge volume enabled access of the steep residual stress profile within the first 1 mm.

This paper summarizes recent results of an exhaustive experimental study on possible uses of bent perfect crystal (BPC) slabs of Si employed in the fully asymmetric diffraction (FAD) geometry. In all cases the FAD-BPC slab is employed as the second crystal of the dispersive double-crystal setting in combination with another BPC slab. The FAD geometry was tested in the output beam expansion (OBE) as well as in the output beam compression (OBC) diffraction orientations. A comparison of dispersive parallel [ ] and antiparallel [ ] settings was carried out with the FAD-BPC slab in the OBE orientation. High-resolution properties of the dispersive double-crystal settings are demonstrated by several experimental results, e.g. edge refraction or powder diffraction. Due to the given experimental conditions, for FAD geometry studies, we used Si(311) crystal planes having 29.5° with respect to the main surface of the crystal slab.

A global approach coupling the moderator to the beam extraction system has been applied for the design optimization of the thermal and cold moderators of the European Spallation Source (ESS), which will be the brightest neutron source in the world for condensed-matter studies. The design is based on the recently developed high-brightness low-dimensional moderator concepts. Para-hydrogen is used for the cold neutron source, while thermal neutrons are provided by moderation in water. The overall moderation configuration was chosen in order to satisfy a range of requirements on bispectral extraction, beamport configuration and instrument performance. All instruments are served by a single moderator assembly above the target, arranged in a `butterfly' geometry with a height of 3 cm. This was determined to be the optimal height for trade-off between high brightness and efficient guide illumination, by analysis of the performance of 23 instruments, based on the reference suite of the ESS Technical Design Report. The concept of `brilliance transfer' is introduced to quantify the performance of the neutron optical system from the source to the sample. The target monolith incorporates a grid of 42 neutron beamports with an average separation of 6°, allowing a free choice between cold and thermal neutron sources at all instrument positions. With the large number of beamports and the space below the target available for future moderators, ample opportunities are available for future upgrades.