Phonon Raman scattering in A 2 Mn 2 O 7 ATl,In,Y E. Granado, P. G. Pagliuso, J. A. Sanjurjo, and C. Rettori Instituto de Fı ´sica ‘‘Gleb Wataghin,’’ UNICAMP, 13083-970, Campinas-SP, Brazil M. A. Subramanian Dupont Central Research and Development, Experimental Station, Wilmington, Delaware 19880 S.-W Cheong Lucent Technology, Bell Laboratories, Murray Hill, New Jersey 07974 S. B. Oseroff San Diego State University, San Diego, California 92182 Received 8 March 1999 Raman scattering of optical phonons in polycrystalline A 2 Mn 2 O 7 ( A =Y, In, and Tl) are reported as a function of temperature. For A =In and Tl a hardening of the two lowest energy modes is observed below T c that we associate to a phonon modulation of the exchange interaction. These data suggest superexchange as the mechanism responsible for magnetic ordering in these systems. All but one of the Raman modes in the In- and Tl-based compounds appear at lower frequencies when compared with those in the Y-based one. This fre- quency shift may be due to the strong hybridization of the TlIn6 s (5 s ) orbital with O 2 p and Mn 3 d , claimed by recent band-structure calculations on these materials. S0163-18299901733-6 I. INTRODUCTION The ‘‘colossal’’ magnetoresistive CMRmanganese- based compound, Tl 2 Mn 2 O 7 with pyrochlore structure, has recently attracted much attention. 1 It was proposed that the large resistivity change and the ferromagnetic-paramagnetic FM-PMtransition at T c 120 K Ref. 2results from the presence of a significant amount of Mn 3 + due to a large oxygen deficiency in this material. 1 However, detailed struc- tural neutron-scattering analysis in a Tl 2 Mn 2 O 7 sample indi- cated a negligible amount of oxygen deficiency, as well as Mn-O distances that are inconsistent with Mn 3+ /Mn 4 + mixed valence. 3,4 Besides, neutron-scattering spin dynamics studies showed well defined spin waves with a gapless dis- persion relation in the FM phase, different from what was observed for CMR perovskites. 5 On this ground it was pro- posed that CMR in Tl 2 Mn 2 O 7 results from the Mn 4+ /Mn 4 + superexchange SEinteraction and strong spin-fluctuation scattering of charge carriers above and near T c . 6,7 It may be of interest to compare the metallic Tl-based material (0 K) 1 m cmRef. 8with the isostructural In 2 Mn 2 O 7 compound that is also FM with T c 125 K, 2 but insulating. For completeness, the study of Y 2 Mn 2 O 7 com- pound, that is an insulator with a much weaker magnetic coupling ( T c 15 K), 9,10 may be useful to understand the origin of the differences between these compounds. The me- tallic behavior of the Tl-based compound was recently attrib- uted to the hybridization of the TlIn6 s (5 s ) orbitals with O 2 p and Mn 3 d . 11 Also, it was suggested that the strong FM coupling for Tl 2 Mn 2 O 7 and In 2 Mn 2 O 7 was associated to that hybridization. 10 Nevertheless, the actual mechanism for the magnetic coupling in these materials, particularly for the Tl and In-based compounds, is still a subject of discussion. In this work we present phonon Raman scattering data in the A 2 Mn 2 O 7 system A=Y,In,Tl. For the In- and Tl-based compounds, a hardening of two of the low-energy phonons is observed below T c . This is interpreted in terms of a phonon modulation of the exchange interaction. These results sug- gest a similar magnetic coupling mechanism for the Tl 2 Mn 2 O 7 and In 2 Mn 2 O 7 compounds. Except for the high- frequency stretching peak, all Raman modes show decreas- ing frequencies when going from Y- to In- and Tl-based compounds. A simple model, based on the structural differ- ences between these compounds, cannot explain this behav- ior. It is possible that the strong hybridization of the TlIn 6 s (5 s ) orbitals with O 2 p and Mn 3 d found by band- structure calculations may be responsible for this behavior. 10,11 II. EXPERIMENT Polycrystalline A 2 Mn 2 O 7 ( A =Tl,In,Y) were prepared by solid-state reaction of MnO 3 and A 2 O 3 under hydrostatic hy- drothermal conditions in sealed gold tube at 500 °C and 2 kbar pressure. 9 The magnetization measurements were done with a MPMS Quantum Design magnetometer in the range of 2–300 K. The Raman spectra were excited using the 514.5- and 488-nm lines of an Ar + laser, with a power less than 10 mW focused in a spot of 50-m diameter. The scattered light was analyzed by a JY T-64000 spectrometer with a CCD detector. The measurements as a function of temperature were done attaching the samples on a cold finger of a closed-cycle He refrigerator. The spectrometer resolu- tion was better than 1 cm -1 and the temperature accuracy was 1 K. All the Raman measurements were taken on as-grown surfaces of the ceramic samples. PHYSICAL REVIEW B 1 SEPTEMBER 1999-I VOLUME 60, NUMBER 9 PRB 60 0163-1829/99/609/65134/$15.00 6513 ©1999 The American Physical Society