Real and Virtual Kohn Effect in Palladium by Inelastic Neutron Scattering

1975 ◽  
Vol 53 (22) ◽  
pp. 2491-2501 ◽  
Author(s):  
A. P. Miiller

A detailed study has been made of the anomalous lattice vibrations in palladium by inelastic neutron scattering. Anomalous shifts in the phonon frequencies are particularly evident along the [0ζζ] T1 branch at reduced wave vectors [Formula: see text] to 0.4, becoming rapidly weaker at 'off symmetry' wave vectors. (Rather similar effects have also been observed in platinum.) The phonon wave vectors corresponding to possible Kohn transitions in the symmetry planes have been computed, using the Fermi surfaces given in the literature. The results indicate that the anomalous frequency shifts arise largely from transitions across the 'heavy' hole Fermi sheet formed from the fifth band electrons. Measurements along the T1 branch at temperatures between 8 and 853 °K show that the anomalous frequency shifts are smeared out in wave vector and perhaps weakened with increasing temperature. The corresponding phonon line widths, obtained by correction of the neutron groups for instrumental resolution, were found to be anomalously broadened as well, particularly at 8 °K where anharmonic effects are expected to be small. This suggests that the anomalous line widths reflect, in large part, the reduction in phonon lifetimes (and in electron lifetimes) arising from real Kohn transitions. This is believed to be the first identification of phonon line broadening because of electron–phonon interaction in a nonsuperconductor.

Author(s):  
R S Fishman ◽  
George Ostrouchov ◽  
Feng Ye

Abstract This work describes two methods to fit the inelastic neutron-scattering spectrum S(q, ω) with wavector q and frequency ω. The common and well-established method extracts the experimental spin-wave branches ωn(q) from the measured spectra S(q ,ω) and then minimizes the difference between the observed and predicted frequencies. When n branches of frequencies are predicted but the measured frequencies overlap to produce only m < n branches, the weighted average of the predicted frequencies must be compared to the observed frequencies. A penalty is then exacted when the width of the predicted frequencies exceeds the width of the observed frequencies. The second method directly compares the measured and predicted intensities S(q ,ω) over a grid {q i , ωj} in wavevector and frequency space. After subtracting background noise from the observed intensities, the theoretical intensities are scaled by a simple wavevector-dependent function that reflects the instrumental resolution. The advantages and disadvantages of each approach are demonstrated by studying the open honeycomb material Tb2Ir3Ga9.


Catalysts ◽  
2020 ◽  
Vol 10 (11) ◽  
pp. 1255
Author(s):  
Stewart F. Parker

Inelastic neutron scattering (INS) spectroscopy is used to explore the 0–12,000 cm−1 range to characterise the interaction of H2 with iron benzene-1,3,5-tricarboxylate (Fe-BTC). Two peaks are observed in the low energy (<350 cm−1) region after exposure to H2. Measurements with hydrogen deuteride (HD) confirm that the peaks originate from H2. The most likely explanation is that there are two populations of H2 (HD) present. For both the H2- and the HD-loaded samples, the higher energy peak is close in energy to that of the pure isotopomer, so it is assigned to bulk-like H2/HD held in pores of the Fe-BTC. The lower energy peak is assigned to H2/HD interacting directly with the Fe ion exposed on dehydration. It was also possible to detect the H–H stretch in the same experiment; however, unfortunately, the instrumental resolution is insufficient to separate the stretch modes of the bound H2 (HD) and that in the pores.


1972 ◽  
Vol 50 (23) ◽  
pp. 2915-2927 ◽  
Author(s):  
D. H. Dutton ◽  
B. N. Brockhouse ◽  
A. P. Miiller

The dispersion relations in platinum have been measured at 90 °K by the inelastic scattering of thermal neutrons. Born–von Kármán models of the force system have been calculated by fitting to the dispersion curves. Fourth-neighbor forces, with weaker interactions probably extending to at least sixth neighbors, are required to fit the data. A frequency distribution has been calculated from the force constants of the most realistic model.Some measurements are also reported of frequencies at a temperature of 473 °K. The mean frequency shift from 90 to 473 °K was found to be −2.0%.In the [0ζζ]T1 branch, anomalous behavior, similar to that observed in palladium, has been studied at temperatures of 90, 296, and 473 °K. As in Pd, the anomaly in Pt is markedly broadened and weakened with increasing temperature. The phonon wave vectors corresponding to possible Kohn transitions in the (001) plane have been determined by machine calculation, using Fermi surfaces given in the literature. These results strongly suggest that the anomaly along the T1 branch arises largely from transitions across the "heavy" hole Fermi sheet formed from the fifth-band electrons. A comparison is made with similar results for palladium and nickel.


1992 ◽  
Vol 2 (10) ◽  
pp. 1929-1939 ◽  
Author(s):  
Mariette Barthes ◽  
Juegen Eckert ◽  
Susanna W. Johnson ◽  
Jacques Moret ◽  
Basil I. Swanson ◽  
...  

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