Two-dimensional single crystal monoclinic gallium telluride on silicon substrate via transformation of epitaxial hexagonal phase
Source abstract
Abstract
Abstract Van der Waals (vdW) epitaxial growth of large-area and stable two-dimensional (2D) materials of high structural quality on crystalline substrates is crucial for the development of novel device technologies. 2D gallium monochalcogenides with low in-plane symmetry stand out among the layered semiconductor materials family for next-generation optoelectronic and energy conversion applications. Here, we demonstrate the formation of large-area, single crystal and optically active 2D monoclinic gallium telluride (m-GaTe) on silicon substrate via rapid thermal annealing induced phase transformation of vdW epitaxial metastable hexagonal gallium telluride (h-GaTe). Stabilization of multilayer h-GaTe on Si occurs due to the role of the first layer symmetry together with efficient GaTe surface passivation. Moreover, we show that the phase transformation of h-GaTe to m-GaTe is accompanied by the strain relaxation between Si substrate and GaTe. This work opens the way to the fabrication of single-crystal 2D anisotropic semiconductors on standard crystalline wafers that are difficult to be obtained by epitaxial methods.
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Research context
OpenAlex topics: 2D Materials and Applications · Advanced Thermoelectric Materials and Devices · Perovskite Materials and Applications
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References (69)
Show source-provided references
1. Gong, C. & Zhang, X. Two-dimensional magnetic crystals and emergent heterostructure devices. Science 363, 4450 (2019).10.1126/science.aav4450 ↗
2. Cai, H. et al. Synthesis and emerging properties of 2D layered III-VI metal chalcogenides. Appl. Phys. Rev. 6, 041312 (2019).10.1063/1.5123487 ↗
3. Attaccalite, C., Palummo, M., Cannuccia, E. & Grüning, M. Second-harmonic generation in single-layer monochalcogenides: A response from first-principles real-time simulations. Phys. Rev. Materials 3, 074003 (2019).10.1103/PhysRevMaterials.3.074003 ↗
4. Bejani, M. et al. Lattice vibrations and electronic properties of GaSe nanosheets from first principles. Phys. Rev. Mater. 3, 124003 (2019).10.1103/PhysRevMaterials.3.124003 ↗
5. Bandurin, D. A. et al. High electron mobility, quantum Hall effect and anomalous optical response in atomically thin InSe. Nat. Nanotechnol. 12, 223–227 (2017).10.1038/nnano.2016.242 ↗
6. Mudd, G. W. et al. Tuning the Bandgap of Exfoliated InSe Nanosheets by Quantum Confinement. Adv. Mater. 25, 5714–5718 (2013).10.1002/adma.201302616 ↗
7. Zólyomi, V., Drummond, N. D. & Fal’ko, V. I. Band structure and optical transitions in atomic layers of hexagonal gallium chalcogenides. Phys. Rev. B 87, 195403 (2013).10.1103/PhysRevB.87.195403 ↗
8. Cao, T., Li, Z. & Louie, S. G. Tunable Magnetism and Half-Metallicity in Hole-Doped Monolayer GaSe. Phys. Rev. Lett. 114, 236602 (2015).10.1103/PhysRevLett.114.236602 ↗
9. Zubiaga, A., Garcé, J. A., Plazaola, F., Muñoz-Sanjosé, V. & Martínez-Tomás, C. Near band edge recombination mechanisms in GaTe. Phys. Rev. B 68, 245202 (2003).10.1103/PhysRevB.68.245202 ↗
10. Antonius, G., Qiu, D. Y. & Louie, S. G. Orbital symmetry and the optical response of single-layer mx monochalcogenides. Nano Lett. 18, 1925–1929 (2018).10.1021/acs.nanolett.7b05286 ↗
11. Pearson, W. B. The crystal structures of semiconductors and a general valence rule. Acta Crystallogr. 17, 1–15 (1964).10.1107/S0365110X64000019 ↗
12. Gillan, E. G. & Barron, A. R. Chemical Vapor Deposition of Hexagonal Gallium Selenide and Telluride Films from Cubane Precursors: Understanding the Envelope of Molecular Control. Chem. Mater. 9, 3037–3048 (1997).10.1021/cm9703886 ↗
13. Shangguan, H. et al. Thermoelectric Properties of Two-Dimensional Gallium Telluride. J. Electr. Mater. 48, 5988–5994 (2019).10.1007/s11664-019-07323-2 ↗
14. Huang, S. et al. In-Plane Optical Anisotropy of Layered Gallium Telluride. ACS Nano 10, 8964–8972 (2016).10.1021/acsnano.6b05002 ↗
15. Cai, H. et al. Synthesis of Highly Anisotropic Semiconducting GaTe Nanomaterials and Emerging Properties Enabled by Epitaxy. Adv. Mater. 29, 1605551 (2017).10.1002/adma.201605551 ↗
16. Liu, F. et al. High-Sensitivity Photodetectors Based on Multilayer GaTe Flakes. ACS Nano 8, 752–760 (2014).10.1021/nn4054039 ↗
17. Wang, Z. et al. High-performance flexible photodetectors based on GaTe nanosheets. Nanoscale 7, 7252–7258 (2015).10.1039/C4NR07313D ↗
18. Rhodes, D., Chae, S. H., Ribeiro-Palau, R. & Hone, J. Disorder in van der Waals heterostructures of 2D materials. Nat. Mater. 18, 541–549 (2019).10.1038/s41563-019-0366-8 ↗
19. Koma, A. Summary Abstract: Fabrication of ultrathin heterostructures with van der Waals epitaxy. J. Vacuum Sci. Technol. B: Microelectr. Nanometer Struct. 3, 724 (1985).10.1116/1.583125 ↗
20. Ehlen, N. et al. Narrow photoluminescence and Raman peaks of epitaxial MoS 2 on graphene/Ir(1 1 1). 2D Materials 6, 011006 (2018).10.1088/2053-1583/aaebd3 ↗
21. Pacuski, W. et al. Narrow Excitonic Lines and Large-Scale Homogeneity of Transition-Metal Dichalcogenide Monolayers Grown by Molecular Beam Epitaxy on Hexagonal Boron Nitride. Nano Lett. 20, 3058–3066 (2020).10.1021/acs.nanolett.9b04998 ↗
22. Yu, Y. et al. Phase-Engineered Synthesis of Ultrathin Hexagonal and Monoclinic GaTe Flakes and Phase Transition Study. Adv. Funct. Mater. 29, 1901012 (2019).10.1002/adfm.201901012 ↗
23. Claro, M. S., Grzonka, J., Nicoara, N., Ferreira, P. J. & Sadewasser, S. Wafer-Scale Fabrication of 2D β-In2Se3 Photodetectors. Adv. Opt. Mater. 9, 2001034 (2021).10.1002/adom.202001034 ↗
24. Lee, C. H. et al. Molecular beam epitaxy of 2D-layered gallium selenide on GaN substrates. J. Appl. Phys. 121, 094302 (2017).10.1063/1.4977697 ↗
25. Chen, M.-W. et al. Large-grain MBE-grown GaSe on GaAs with a Mexican hat-like valence band dispersion. npj 2D Mater. Appl. 2, 2 (2018).10.1038/s41699-017-0047-x ↗
26. Yuan, X. et al. Wafer-scale arrayed p-n junctions based on few-layer epitaxial GaTe. Nano Res. 8, 3332–3341 (2015).10.1007/s12274-015-0833-8 ↗
27. Bae, C. J. et al. Influence of thickness on crystallinity in wafer-scale GaTe nanolayers grown by molecular beam epitaxy. AIP Adv. 7, 035113 (2017).10.1063/1.4978776 ↗
28. Huynh, S. H. et al. Molecular Beam Epitaxy of Two-Dimensional GaTe Nanostructures on GaAs(001) Substrates: Implication for Near-Infrared Photodetection. ACS Appl. Nano Mater. 4, 8913–8921 (2021).10.1021/acsanm.1c01544 ↗
29. Boschker, J. E. et al. Surface reconstruction-induced coincidence lattice formation between two-dimensionally bonded materials and a three-dimensionally bonded substrate. Nano Lett. 14, 3534–3538 (2014).10.1021/nl5011492 ↗
30. Wang, R. et al. Toward truly single crystalline GeTe films: The relevance of the substrate surface. J. Phys. Chem. C 118, 29724–29730 (2014).10.1021/jp507183f ↗
31. Bengió, S., Martin, M., Avila, J., Asensio, M. & Ascolani, H. Atomic structure of the Sb-terminated Si(111) surface: A photoelectron diffraction study. Phys. Rev. B 65, 205326 (2002).10.1103/PhysRevB.65.205326 ↗
32. Liu, Z. et al. Direct Growth of Graphene/Hexagonal Boron Nitride Stacked Layers. Nano Lett. 11, 2032–2037 (2011).10.1021/nl200464j ↗
33. Dau, M. T. et al. Beyond van der Waals Interaction: The Case of MoSe 2 Epitaxially Grown on Few-Layer Graphene. ACS Nano 12, 2319–2331 (2018).10.1021/acsnano.7b07446 ↗
34. Sutter, P. & Sutter, E. Growth Mechanisms of Anisotropic Layered Group IV Chalcogenides on van der Waals Substrates for Energy Conversion Applications. ACS Appl. Nano Mater. 1, 3026–3034 (2018).10.1021/acsanm.8b00660 ↗
35. J Lopes, J. M. et al. Large-area van der Waals epitaxy and magnetic characterization of Fe3 GeTe2 films on graphene. 2D Materials 8, 041001 (2021).10.1088/2053-1583/ac171d ↗
36. Klein, A. & Jaegermann, W. Review-Electronic Properties of 2D Layered Chalcogenide Surfaces and Interfaces grown by (quasi) van der Waals Epitaxy. ECS J. Solid State Sci. Technol. 9, 093012 (2020).10.1149/2162-8777/abb750 ↗
37. Wofford, J. M. et al. A hybrid MBE-based growth method for large-area synthesis of stacked hexagonal boron nitride/graphene heterostructures. Sci. Rep. 7, 43644 (2017).10.1038/srep43644 ↗
38. Zallo, E. et al. Modulation of van der Waals and classical epitaxy induced by strain at the Si step edges in GeSbTe alloys. Sci. Rep. 7, 1466 (2017).10.1038/s41598-017-01502-z ↗
39. Mortelmans, W. et al. Role of Stronger Interlayer van der Waals Coupling in Twin-Free Molecular Beam Epitaxy of 2D Chalcogenides. Adv. Mater. Interfaces 8, 2100438 (2021).10.1002/admi.202100438 ↗
40. Bandura, A. V., Kovalenko, A. V., Kuruch, D. D. & Evarestov, R. A. Lattice Dynamics and Thermodynamic Properties of Bulk Phases and Monolayers of GaTe and InTe: A Comparison from First-Principles Calculations. Eur. J. Inorg. Chem. 2021, 126–138 (2021).10.1002/ejic.202000634 ↗
41. Shenoy, U. S. et al. Electronic structure and properties of layered gallium telluride. Chem. Phys. Lett. 651, 148–154 (2016).10.1016/j.cplett.2016.03.045 ↗
42. Soubelet, P., Bruchhausen, A. E., Fainstein, A., Nogajewski, K. & Faugeras, C. Resonance effects in the Raman scattering of monolayer and few-layer MoSe 2. Phys. Rev. B 93, 155407 (2016).10.1103/PhysRevB.93.155407 ↗
43. Zaytseva, Y. S., Borgardt, N. I., Prikhodko, A. S., Zallo, E. & Calarco, R. Electron-Microscopy Studies of the Structure of Thin Epitaxial Ge2Sb2Te5 Layers Grown on Si(111) Substrates. Semiconductors 55, 1033–1038 (2021).10.1134/S106378262113011X ↗
44. Hÿtch, M. J., Putaux, J.-L. & Pénisson, J.-M. Measurement of the displacement field of dislocations to 0.03 A by electron microscopy. Nature 423, 270–273 (2003).10.1038/nature01638 ↗
45. Shimizu-Iwayama, T. et al. Visible photoluminescence in Si+-implanted silica glass. J. Appl. Phys. 75, 7779–7783 (1994).10.1063/1.357031 ↗
46. Schmidt, H. et al. Thermal stability and crystallization kinetics of sputtered amorphous Si3N4 films. Thin Solid Films 450, 346–351 (2004).10.1016/j.tsf.2003.11.274 ↗
47. Mercado, E. et al. Passivation of Layered Gallium Telluride by Double Encapsulation with Graphene. ACS Omega 4, 18002–18010 (2019).10.1021/acsomega.9b01752 ↗
48. Kotha, M., Murray, T., Tuschel, D. & Gallis, S. Study of Oxidation and Polarization-Dependent Optical Properties of Environmentally Stable Layered GaTe Using a Novel Passivation Approach. Nanomaterials 9, 1510 (2019).10.3390/nano9111510 ↗
49. Stadelmann, P. A. EMS - a software package for electron diffraction analysis and HREM image simulation in materials science. Ultramicroscopy 21, 131–145 (1987).10.1016/0304-3991(87)90080-5 ↗
50. Pozo-Zamudio, O. D. et al. Photoluminescence of two-dimensional GaTe and GaSe films. 2D Mater. 2, 035010 (2015).10.1088/2053-1583/2/3/035010 ↗
51. Spindler, C., Galvani, T., Wirtz, L., Rey, G. & Siebentritt, S. Excitation-intensity dependence of shallow and deep-level photoluminescence transitions in semiconductors. J. Appl. Phys. 126, 175703 (2019).10.1063/1.5095235 ↗
52. Olmos-Asar, J. A., Leão, C. R. & Fazzio, A. Novel III-Te-graphene van der Waals heterojunctions for optoelectronic devices. RSC Adv. 7, 32383–32390 (2017).10.1039/C7RA03369A ↗
53. Wu, Y. et al. Quantum Confinement and Gas Sensing of Mechanically Exfoliated GaSe. Adv. Mater. Technol. 2, 1600197 (2017).10.1002/admt.201600197 ↗
54. Zhao, Q. et al. Thickness-induced structural phase transformation of layered gallium telluride. Phys Chem. Chem. Phys. 18, 18719–18726 (2016).10.1039/C6CP01963C ↗
55. Ayadi, T., Debbichi, L., Said, M. & Lebègue, S. An ab initio study of the electronic structure of indium and gallium chalcogenide bilayers. J. Chem. Phys. 147, 114701 (2017).10.1063/1.4997233 ↗
56. Dong, J., Zhang, L., Dai, X. & Ding, F. The epitaxy of 2d materials growth. Nat Commun. 11, 5862 (2020).10.1038/s41467-020-19752-3 ↗
57. Arciprete, F. et al. Hints for a General Understanding of the Epitaxial Rules for van der Waals Epitaxy from Ge-Sb-Te Alloys. Adv. Mater. Interfaces 9, 2101556 (2022).10.1002/admi.202101556 ↗
58. Oura, K., Katayama, M., Zotov, A.V., Lifshits, V.G., Saranin, A.A.: Growth of Thin Films. In: Oura, K., Katayama, M., Zotov, A.V., Lifshits, V.G., Saranin, A.A. (eds.) Surface Science: An Introduction. Advanced Texts in Physics, pp. 357-387. Springer, Berlin, Heidelberg (2003). https://doi.org/10.1007/978-3-662-05179-5_14. Accessed 2022-03-10.10.1007/978-3-662-05179-5_14 ↗
59. Kilaas, R. Optimal and near-optimal filters in high-resolution electron microscopy. J. Microsc. 190, 45–51 (1998).10.1046/j.1365-2818.1998.3070861.x ↗
60. Peters, J.J.P.: Strain++ Software. https://jjppeters.github.io/Strainpp/
61. Stukowski, A. Visualization and analysis of atomistic simulation data with OVITO-the Open Visualization Tool. Model. Simulat. Mater. Sci. Engin. 18, 015012 (2010).10.1088/0965-0393/18/1/015012 ↗
62. Kriegner, D., Wintersberger, E. & Stangl, J. xrayutilities: a versatile tool for reciprocal space conversion of scattering data recorded with linear and area detectors. J. Appl. Crystallography 46, 1162–1170 (2013).10.1107/S0021889813017214 ↗
63. Giannozzi, P. et al. Quantum espresso: a modular and open-source software project for quantum simulations of materials. J. Phys. Condens. Matt. 21, 395502 (2009).10.1088/0953-8984/21/39/395502 ↗
64. Perdew, J. P., Burke, K. & Ernzerhof, M. Generalized Gradient Approximation Made Simple. Phys. Rev. Lett. 77, 3865–3868 (1996).10.1103/PhysRevLett.77.3865 ↗
65. Hamada, I. van der Waals density functional made accurate. Phys. Rev. B 89, 121103 (2014).10.1103/PhysRevB.89.121103 ↗
66. Hamann, D. R. Optimized norm-conserving Vanderbilt pseudopotentials. Phys. Rev. B 88, 085117 (2013).10.1103/PhysRevB.88.085117 ↗
67. van Setten, M. J. et al. The pseudodojo: Training and grading a 85 element optimized norm-conserving pseudopotential table. Comput. Phys. Commun. 226, 39–54 (2018).10.1016/j.cpc.2018.01.012 ↗
68. Persson, K. Materials Data on GaTe (SG:194) by Materials Project. An optional note (2014). https://doi.org/10.17188/1184820.10.17188/1184820 ↗
69. Lazić, P. Cellmatch: Combining two unit cells into a common supercell with minimal strain. Comput. Phys. Commun. 197, 324–334 (2015).10.1016/j.cpc.2015.08.038 ↗