19 research outputs found

    HgGa2Se4 under high pressure: an optical absorption study

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    High-pressure optical absorption measurements have been performed in defect chalcopyrite HgGa2Se4 to investigate the influence of pressure on the bandgap energy and its relation with the pressure-induced order-disorder processes that occur in this ordered-vacancy compound. Two different experiments have been carried out in which the sample undergoes either a partial or a total pressure-induced disorder process at 15.4 and 30.8GPa, respectively. It has been found that the direct bandgap energies of the recovered samples at 1GPa were around 0.15 and 0.23eV smaller than that of the original sample, respectively, and that both recovered samples have different pressure coefficients of the direct bandgap than the original sample. A comprehensive explanation for these results on the basis of pressure-induced order-disorder processes is provided.This study was supported by the Spanish government MEC under Grants No: MAT2010-21270-C04-01/03/04 and MAT2013-46649-C4-1/2/3-P, by MALTA Consolider Ingenio 2010 project (CSD2007-00045), by Generalitat Valenciana (GVA-ACOMP-2013-1012 and GVA-ACOMP-2014-243), and by the Vicerrectorado de Investigacion y Desarrollo of the Universitat Politecnica de Valencia (UPV2011-0914 PAID-05-11 and UPV2011-0966 PAID-06-11). E. P.-G., J. L.-S., P. R.-H, and A. M. acknowledge computing time provided by Red Espanola de Supercomputacion (RES) and MALTA-Cluster. J.R.-F. thanks the Alexander von Humboldt foundation for a postdoctoral fellowship.Gomis, O.; Vilaplana Cerda, RI.; Manjón Herrera, FJ.; Ruiz-Fuertes, J.; Pérez-González, E.; López-Solano, J.; Bandiello, E.... (2015). HgGa2Se4 under high pressure: an optical absorption study. physica status solidi (b). 252(9):2043-2051. https://doi.org/10.1002/pssb.201451714S204320512529Bernard, J. E., & Zunger, A. (1988). Ordered-vacancy-compound semiconductors: PseudocubicCdIn2Se4. Physical Review B, 37(12), 6835-6856. doi:10.1103/physrevb.37.6835Jiang, X., & Lambrecht, W. R. L. (2004). Electronic band structure of ordered vacancy defect chalcopyrite compounds with formulaII−III2−VI4. Physical Review B, 69(3). doi:10.1103/physrevb.69.035201Burlakov, I. I., Raptis, Y., Ursaki, V. V., Anastassakis, E., & Tiginyanu, I. M. (1997). Order-disorder phase transition in CdAl2S4 under hydrostatic pressure. Solid State Communications, 101(5), 377-381. doi:10.1016/s0038-1098(96)00602-3Gonz�lez, J., Rico, R., Calder�n, E., Quintero, M., & Morocoima, M. (1999). Absorption Edge of MnGa2Se4 Single Crystals under Hydrostatic Pressure. physica status solidi (b), 211(1), 45-49. doi:10.1002/(sici)1521-3951(199901)211:13.0.co;2-8Ursaki, V. V., Burlakov, I. I., Tiginyanu, I. M., Raptis, Y. S., Anastassakis, E., & Anedda, A. (1999). Phase transitions in defect chalcopyrite compounds under hydrostatic pressure. Physical Review B, 59(1), 257-268. doi:10.1103/physrevb.59.257Grzechnik, A., Ursaki, V. V., Syassen, K., Loa, I., Tiginyanu, I. M., & Hanfland, M. (2001). Pressure-Induced Phase Transitions in Cadmium Thiogallate CdGa2Se4. Journal of Solid State Chemistry, 160(1), 205-211. doi:10.1006/jssc.2001.9224Mitani, T., Onari, S., Allakhverdiev, K., Gashimzade, F., & Kerimova, T. (2001). Raman Scattering in CdGa2S4 under Pressure. physica status solidi (b), 223(1), 287-291. doi:10.1002/1521-3951(200101)223:13.0.co;2-bTatsi, A., Lampakis, D., Liarokapis, E., Lopez, S. A., Martinez, L., & Giriat, W. (2002). Pressure Effects in Phonon Modes and Structure of A II B 2 III C 4 IV Compounds and Combinations. High Pressure Research, 22(1), 89-93. doi:10.1080/08957950211338Tiginyanu, I. M., Ursaki, V. V., Manjón, F. J., & Tezlevan, V. E. (2003). Raman scattering study of pressure-induced phase transitions in AIIB2IIIC4VI defect chalcopyrites and spinels. Journal of Physics and Chemistry of Solids, 64(9-10), 1603-1607. doi:10.1016/s0022-3697(03)00098-2Mitani, T., Naitou, T., Matsuishi, K., Onari, S., Allakhverdiev, K., Gashimzade, F., & Kerimova, T. (2003). Raman scattering in CdGa2Se4 under pressure. physica status solidi (b), 235(2), 321-325. doi:10.1002/pssb.200301579Allakhverdiev, K., Gashimzade, F., Kerimova, T., Mitani, T., Naitou, T., Matsuishi, K., & Onari, S. (2003). Raman scattering under pressure in ZnGa2Se4. Journal of Physics and Chemistry of Solids, 64(9-10), 1597-1601. doi:10.1016/s0022-3697(03)00077-5Marquina, J., Power, C., Grima, P., Morocoima, M., Quintero, M., Couzinet, B., … González, J. (2006). Crystallographic properties of the MnGa2Se4 compound under high pressure. Journal of Applied Physics, 100(9), 093513. doi:10.1063/1.2358826Meenakshi, S., Vijyakumar, V., Godwal, B. K., Eifler, A., Orgzall, I., Tkachev, S., & Hochheimer, H. D. (2006). High pressure X-ray diffraction study of CdAl2Se4 and Raman study of AAl2Se4 (A=Hg, Zn) and CdAl2X4 (X=Se, S). Journal of Physics and Chemistry of Solids, 67(8), 1660-1667. doi:10.1016/j.jpcs.2006.02.015Errandonea, D., Kumar, R. S., Manjón, F. J., Ursaki, V. V., & Tiginyanu, I. M. (2008). High-pressure x-ray diffraction study on the structure and phase transitions of the defect-stannite ZnGa2Se4 and defect-chalcopyrite CdGa2S4. Journal of Applied Physics, 104(6), 063524. doi:10.1063/1.2981089Meenakshi, S., Vijayakumar, V., Eifler, A., & Hochheimer, H. D. (2010). Pressure-induced phase transition in defect Chalcopyrites HgAl2Se4 and CdAl2S4. Journal of Physics and Chemistry of Solids, 71(5), 832-835. doi:10.1016/j.jpcs.2010.02.007Singh, P., Sharma, M., Verma, U. P., & Jensen, P. (2010). Pressure effects on energy gaps and phase transitions in ZnAl2Se4. Zeitschrift für Kristallographie, 225(11). doi:10.1524/zkri.2010.1301Manjón, F. J., Gomis, O., Rodríguez-Hernández, P., Pérez-González, E., Muñoz, A., Errandonea, D., … Ursaki, V. V. (2010). Nonlinear pressure dependence of the direct band gap in adamantine ordered-vacancy compounds. Physical Review B, 81(19). doi:10.1103/physrevb.81.195201Verma, U. P., Singh, P., & Jensen, P. (2011). A study of the electronic, optical and thermal properties for ZnAl2Se4 using the FP-LAPW method. physica status solidi (b), 248(7), 1682-1689. doi:10.1002/pssb.201046389Gomis, O., Vilaplana, R., Manjón, F. J., Pérez-González, E., López-Solano, J., Rodríguez-Hernández, P., … Ursaki, V. V. (2012). High-pressure optical and vibrational properties of CdGa2Se4: Order-disorder processes in adamantine compounds. Journal of Applied Physics, 111(1), 013518. doi:10.1063/1.3675162Gomis, O., Vilaplana, R., Manjón, F. J., Santamaría-Pérez, D., Errandonea, D., Pérez-González, E., … Ursaki, V. V. (2013). Crystal structure of HgGa2Se4 under compression. Materials Research Bulletin, 48(6), 2128-2133. doi:10.1016/j.materresbull.2013.02.037Gomis, O., Vilaplana, R., Manjón, F. J., Santamaría-Pérez, D., Errandonea, D., Pérez-González, E., … Ursaki, V. V. (2013). High-pressure study of the structural and elastic properties of defect-chalcopyrite HgGa2Se4. Journal of Applied Physics, 113(7), 073510. doi:10.1063/1.4792495Vilaplana, R., Robledillo, M., Gomis, O., Sans, J. A., Manjón, F. J., Pérez-González, E., … Ursaki, V. V. (2013). Vibrational study of HgGa2S4under high pressure. Journal of Applied Physics, 113(9), 093512. doi:10.1063/1.4794096Vilaplana, R., Gomis, O., Pérez-González, E., Ortiz, H. M., Manjón, F. J., Rodríguez-Hernández, P., … Tiginyanu, I. M. (2013). High-pressure Raman scattering study of defect chalcopyrite and defect stannite ZnGa2Se4. Journal of Applied Physics, 113(23), 233501. doi:10.1063/1.4810854Vilaplana, R., Gomis, O., Manjón, F. J., Ortiz, H. M., Pérez-González, E., López-Solano, J., … Tiginyanu, I. M. (2013). Lattice Dynamics Study of HgGa2Se4at High Pressures. The Journal of Physical Chemistry C, 117(30), 15773-15781. doi:10.1021/jp402493rGomis, O., Santamaría-Pérez, D., Vilaplana, R., Luna, R., Sans, J. A., Manjón, F. J., … Ursaki, V. V. (2014). Structural and elastic properties of defect chalcopyrite HgGa2S4 under high pressure. Journal of Alloys and Compounds, 583, 70-78. doi:10.1016/j.jallcom.2013.08.123Errandonea, D., Kumar, R. S., Gomis, O., Manjón, F. J., Ursaki, V. V., & Tiginyanu, I. M. (2013). X-ray diffraction study on pressure-induced phase transformations and the equation of state of ZnGa2Te4. Journal of Applied Physics, 114(23), 233507. doi:10.1063/1.4851735Sans, J. Á., Santamaría-Pérez, D., Popescu, C., Gomis, O., Manjón, F. J., Vilaplana, R., … Tiginyanu, I. M. (2014). Structural and Vibrational Properties of CdAl2S4under High Pressure: Experimental and Theoretical Approach. The Journal of Physical Chemistry C, 118(28), 15363-15374. doi:10.1021/jp5037926Manjón, F. J., & Vilaplana, R. I. (2014). AB2S4\mathrm {AB}_{2}\text {S}_{4} Ordered-Vacancy Compounds at High Pressures. Springer Series in Materials Science, 133-161. doi:10.1007/978-3-642-40367-5_5Gomis, Ó., & Manjón, F. J. (2014). AB2Se4\mathrm{AB}_{2} \text {Se}_{4} Ordered-Vacancy Compounds at High Pressures. Springer Series in Materials Science, 163-184. doi:10.1007/978-3-642-40367-5_6Muñoz, A., & Fuentes-Cabrera, M. (2014). Theoretical Ab Initio Calculations in Ordered-Vacancy Compounds at High Pressures. Springer Series in Materials Science, 185-210. doi:10.1007/978-3-642-40367-5_7Santamaría-Pérez, D., Gomis, O., Pereira, A. L. J., Vilaplana, R., Popescu, C., Sans, J. A., … Tiginyanu, I. M. (2014). Structural and Vibrational Study of Pseudocubic CdIn2Se4under Compression. The Journal of Physical Chemistry C, 118(46), 26987-26999. doi:10.1021/jp5077565Letoullec, R., Pinceaux, J. P., & Loubeyre, P. (1988). The membrane diamond anvil cell: A new device for generating continuous pressure and temperature variations. High Pressure Research, 1(1), 77-90. doi:10.1080/08957958808202482Mao, H. K., Xu, J., & Bell, P. M. (1986). Calibration of the ruby pressure gauge to 800 kbar under quasi-hydrostatic conditions. Journal of Geophysical Research, 91(B5), 4673. doi:10.1029/jb091ib05p04673González-Leal, J.-M., Prieto-Alcón, R., Angel, J.-A., Minkov, D. A., & Márquez, E. (2002). Influence of substrate absorption on the optical and geometrical characterization of thin dielectric films. Applied Optics, 41(34), 7300. doi:10.1364/ao.41.007300Eggert, J. H., Xu, L., Che, R., Chen, L., & Wang, J. (1992). High pressure refractive index measurements of 4:1 methanol:ethanol. Journal of Applied Physics, 72(6), 2453-2461. doi:10.1063/1.351591Errandonea, D., Manj�n, F. J., Pellicer, J., Segura, A., & Mu�oz, V. (1999). Direct to Indirect Crossover in III-VI Layered Compounds and Alloys under Pressure. physica status solidi (b), 211(1), 33-38. doi:10.1002/(sici)1521-3951(199901)211:13.0.co;2-mManjón, F. J., Errandonea, D., Segura, A., Muñoz, V., Tobías, G., Ordejón, P., & Canadell, E. (2001). Experimental and theoretical study of band structure of InSe andIn1−xGaxSe(x3.0.co;2-2Rinco´n, C. (1992). Order-disorder transition in ternary chalcopyrite compounds and pseudobinary alloys. Physical Review B, 45(22), 12716-12719. doi:10.1103/physrevb.45.12716Manjón, F. J., Gomis, O., Vilaplana, R., Sans, J. A., & Ortiz, H. M. (2013). Order-disorder processes in adamantine ternary ordered-vacancy compounds. physica status solidi (b), 250(8), 1496-1504. doi:10.1002/pssb.201248596Cohen, M. L., & Bergstresser, T. K. (1966). Band Structures and Pseudopotential Form Factors for Fourteen Semiconductors of the Diamond and Zinc-blende Structures. Physical Review, 141(2), 789-796. doi:10.1103/physrev.141.789Reimann, K., Haselhoff, M., Rübenacke, S., & Steube, M. (1996). Determination of the Pressure Dependence of Band-Structure Parameters by Two-Photon Spectroscopy. physica status solidi (b), 198(1), 71-80. doi:10.1002/pssb.2221980110Wei, S.-H., & Zunger, A. (1999). Predicted band-gap pressure coefficients of all diamond and zinc-blende semiconductors: Chemical trends. Physical Review B, 60(8), 5404-5411. doi:10.1103/physrevb.60.5404González, J., & Rincón, C. (1989). Optical absorption and phase transitions in CuInSe2and CuInS2single crystals at high pressure. Journal of Applied Physics, 65(5), 2031-2034. doi:10.1063/1.342897Wei, S.-H., Ferreira, L. G., & Zunger, A. (1992). First-principles calculation of the order-disorder transition in chalcopyrite semiconductors. Physical Review B, 45(5), 2533-2536. doi:10.1103/physrevb.45.2533Lempert, R. J., Hass, K. C., & Ehrenreich, H. (1987). Molecular coherent-potential approximation for zinc-blende pseudobinary alloys. Physical Review B, 36(2), 1111-1129. doi:10.1103/physrevb.36.1111Wei, S. ‐H., & Zunger, A. (1990). Band‐gap narrowing in ordered and disordered semiconductor alloys. Applied Physics Letters, 56(7), 662-664. doi:10.1063/1.103307Iota, V., & Weinstein, B. A. (1999). 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    Lattice dynamics study of HgGa2Se4 at high pressures

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    We report on Raman scattering measurements in mercury digallium selenide (HgGa2Se4) up to 25 GPa. We also performed, for the low-pressure defect-chalcopyrite structure, lattice-dynamics ab initio calculations at high pressures which agree with experiments. Measurements evidence that the semiconductor HgGa2Se4 exhibits a pressure-induced phase transition above 19 GPa to a previously undetected structure. This transition is followed by a transformation to a Raman-inactive phase above 23.4 GPa. On downstroke from 25 GPa until 2.5 GPa, a broad Raman spectrum was observed, which has been attributed to a fourth phase, and whose pressure dependence was followed during a second upstroke. Candidate structures for the three phases detected under compression are proposed. Finally, we also report and discuss the decomposition of the sample by laser heating at pressures close to 19 GPa. As possible products of decomposition, we have identified at least the formation of trigonal selenium nanoclusters and cinnabar-type HgSe.This study was supported by the Spanish government MEC under Grant No. MAT2010-21270-004-01/03/04, by MALTA Consolider Ingenio 2010 project (CSD2007-00045), by Generalitat Valenciana through project GVA-ACOMP-2013-012, and by the Vicerrectorado de Investigacion y Desarrollo of the Universidad Politecnica de Valencia (UPV2011-0966 and UPV2011-0914). E.P.-G., J.L.-S., A.M., and P.R.-H. acknowledge computing time provided by Red Espanola de Super-computacion (RES) and MALTA-Cluster.Vilaplana Cerda, RI.; Gomis Hilario, O.; Manjón Herrera, FJ.; Ortiz, HM.; Pérez González, E.; López Solano, J.; Rodríguez Hernández, P.... (2013). Lattice dynamics study of HgGa2Se4 at high pressures. Journal of Physical Chemistry C. 117(30):15773-15781. https://doi.org/10.1021/jp402493rS15773157811173

    High‐Throughput Optimization of Magnetoresistance Materials Based on Lock‐In Thermography

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    Abstract With the giant magnetoresistance (GMR) effect serving as a vital component in modern spintronic technologies, researchers are dedicating significant efforts to improve the performance of GMR devices through material exploration and design optimization. However, traditional GMR measurement approaches are inefficient for comprehensive material and device optimization. This study proposes a high‐throughput current‐in‐plane GMR measurement technique based on thermal imaging of Joule heating utilizing lock‐in thermography (LIT). This LIT‐based technique is advantageous for efficiently evaluating films with varying compositions and thickness gradients, which is crucial for ongoing material exploration and design optimization to enhance the GMR ratio. First, it is demonstrated that using CoFe/Cu multilayers, the simple Joule heating measurement based on LIT enables quantitative estimation of the GMR ratio. Then, to confirm the usefulness of the proposed method in high‐throughput material screening, a case study is shown to investigate the GMR of CoCu‐based granular films with a composition gradient. These techniques allow to determine the optimum composition with maximum GMR ratio using the single composition‐gradient film and reveal Co22Cu78 as the optimal composition, yielding the largest GMR ratio among the reported polycrystalline CoCu‐based granular films. This demonstration accelerates the material and structural optimization of GMR devices
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