Structure–property coupling in lead-free halides Rb 3 Sb 2 Br 9 and Rb 3 Sb 2 Br 6 I 3 obtained by mechanochemistry
Source abstract
Abstract
Rb 3 Sb 2 X 9 (X = Br, I) halides show a temperature-driven phase transition from monoclinic ( P 2 1 / n ) to trigonal ( P 3̄ m 1). Distortion-mode analysis reveals octahedral rotations as primary drivers, with cation shifts and bond modulations stabilizing the low-symmetry phase.
Source: crossref · Quality: baseline
Research context
OpenAlex topics: Perovskite Materials and Applications · Inorganic Chemistry and Materials · Solid-state spectroscopy and crystallography
SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.
Affiliations
Instituto de Ciencia de Materiales de Madrid, CSIC, Cantoblanco, 28049 Madrid, Spain
Laboratory Inorganic Chemistry, Faculty of Sciences of Sfax, University of Sfax, 3000 Sfax, Tunisia
National Engineering School of Sfax (ENIS), Laboratory of Electromechanical Systems (LASEM), B.P.W., 3038, Sfax, Tunisia
CCAF, PPGCEM/CDTec, Federal University of Pelotas, 96010-610 Pelotas, Rio Grande do Sul, Brazil
Instituto de Investigaciones en Tecnología Química (UNSL-CONICET) and Facultad de Química, Bioquímica y Farmacia, Almirante Brown 1455 (5700), San Luis, Argentina
ESRF – European Synchrotron Radiation Facility, 38000 Grenoble, France
References (48)
Show source-provided references
1. Jena · Chem. Rev. · 2019 · 119 · 303610.1021/acs.chemrev.8b00539 ↗
2. Kovalenko · Science · 2017 · 358 · 74510.1126/science.aam7093 ↗
3. Park · Nat. Energy · 2016 · 1 · 1615210.1038/nenergy.2016.152 ↗
4. Leguy · Chem. Mater. · 2015 · 27 · 339710.1021/acs.chemmater.5b00660 ↗
5. Xiong · Adv. Energy Mater. · 2022 · 12 · 220178710.1002/aenm.202201787 ↗
6. Li · Sol. Energy · 2022 · 233 · 27110.1016/j.solener.2022.01.035 ↗
7. Chen · Nat. Commun. · 2018 · 9 · 480710.1038/s41467-018-07177-y ↗
8. Ming · Adv. Sci. · 2018 · 5 · 170066210.1002/advs.201700662 ↗
9. Chen · Nano Energy · 2025 · 137 · 11078210.1016/j.nanoen.2025.110782 ↗
10. Yang · Nat. Sustainability · 2025 · 8 · 45610.1038/s41893-025-01529-5 ↗
11. Noel · Energy Environ. Sci. · 2014 · 7 · 306110.1039/C4EE01076K ↗
12. Hao · Nat. Photonics · 2014 · 8 · 48910.1038/nphoton.2014.82 ↗
13. Shi · Adv. Mater. · 2017 · 29 · 160500510.1002/adma.201605005 ↗
14. Lu · Nat. Commun. · 2018 · 9 · 340510.1038/s41467-018-05761-w ↗
15. Ahmad · ACS Omega · 2020 · 5 · 2840410.1021/acsomega.0c04174 ↗
16. Weber · ACS Appl. Energy Mater. · 2019 · 2 · 53910.1021/acsaem.8b01572 ↗
17. Valakh · J. Mol. Struct. · 1997 · 436–437 · 30910.1016/S0022-2860(97)00204-4 ↗
18. Byeon · New Phys.: Sae Mulli · 2019 · 69 · 149
19. Correa-Baena · Energy Environ. Sci. · 2017 · 10 · 71010.1039/C6EE03397K ↗
20. McMeekin · Science · 2016 · 351 · 15110.1126/science.aad5845 ↗
21. López · Inorg. Chem. · 2024 · 63 · 1264110.1021/acs.inorgchem.4c01861 ↗
22. Abia · CrystEngComm · 2023 · 25 · 185710.1039/D2CE01488B ↗
23. Abia · ACS Appl. Mater. Interfaces · 2023 · 15 · 4076210.1021/acsami.3c07707 ↗
24. Abia · J. Mater. Chem. C · 2022 · 10 · 685710.1039/D2TC00653G ↗
25. Abia · Inorg. Chem. · 2022 · 61 · 550210.1021/acs.inorgchem.1c03841 ↗
26. Chakroun · Inorg. Chem. · 2024 · 63 · 2225810.1021/acs.inorgchem.4c03920 ↗
27. McCall · Chem. Mater. · 2017 · 29 · 412910.1021/acs.chemmater.7b01184 ↗
28. McCall · ACS Photonics · 2018 · 5 · 374810.1021/acsphotonics.8b00813 ↗
29. Correa-Baena · Chem. Mater. · 2018 · 30 · 373410.1021/acs.chemmater.8b00676 ↗
30. Luo · J. Mater. Chem. C · 2024 · 12 · 1306110.1039/D4TC01803F ↗
31. Perez-Mato · Acta Crystallogr., Sect. A: Found. Crystallogr. · 2010 · 66 · 55810.1107/S0108767310016247 ↗
32. Aroyo · Z. Kristallogr. - Cryst. Mater. · 2006 · 221 · 1510.1524/zkri.2006.221.1.15 ↗
33. Perez-Mato · J. Phys.: Conf. Ser. · 2010 · 226 · 012011
34. Fitch · J. Synchrotron Radiat. · 2023 · 30 · 110.1107/S1600577523004915 ↗
35. Rodríguez-Carvajal · Phys. B · 1993 · 192 · 5510.1016/0921-4526(93)90108-I ↗
36. Erba · J. Chem. Theory Comput. · 2023 · 19 · 689110.1021/acs.jctc.2c00958 ↗
37. Perdew · Phys. Rev. Lett. · 2008 · 100 · 13640610.1103/PhysRevLett.100.136406 ↗
38. Laun · J. Comput. Chem. · 2018 · 39 · 128510.1002/jcc.25195 ↗
39. Abrahams · J. Solid State Chem. · 2001 · 160 · 38210.1006/jssc.2001.9251 ↗
40. Peresh · Inorg. Mater. · 2011 · 47 · 20810.1134/S0020168511010109 ↗
41. Kroumova · Phase Transitions · 2003 · 76 · 15510.1080/0141159031000076110 ↗
42. Rousseau · J. Raman Spectrosc. · 1981 · 10 · 25310.1002/jrs.1250100152 ↗
43. Rodrigues · J. Alloys Compd. · 2020 · 813 · 15213610.1016/j.jallcom.2019.152136 ↗
44. Pecharromán · Appl. Spectrosc. · 2000 · 54 · 63410.1366/0003702001949843 ↗
45. Rodrigues · Ind. Eng. Chem. Res. · 2021 · 60 · 1891810.1021/acs.iecr.1c02188 ↗
46. Chang · Z. Anorg. Allg. Chem. · 2016 · 642 · 73610.1002/zaac.201600179 ↗
47. L. D.Landau and E. M.Lifshitz , Statistical Physics: Volume 5, Part 1 , Pergamon , Oxford , 1st edn, 1959
48. J. A.Alonso , M.Chivite Lacaba , J. E.Figueiredo Soares Rodrigues , J.Gainza Martin and R.Santos Silva Jr. , Unveiling the structure and lone pair behaviour of the Pb-free halides A3Bi2Br9 and A3Bi2Br6I3 (A = Cs, Rb), with photovoltaic applications [Dataset] , European Synchrotron Radiation Facility, 2027 10.15151/ESRF-ES-191153300910.15151/ESRF-ES-1911533009 ↗