Da Silva, Estelina Lora; Skelton, J. M.; Rodríguez-Hernández, P.; Muñoz, A.; Santos, M. C.; Martínez-García, D.; Vilaplana Cerda, Rosario Isabel; Manjón, Francisco-Javier(The Royal Society of Chemistry, 2022-10-20)
[EN]
We report a comparative theoretical study of the Pnma and R3m phases of Sb2S3, Bi2S3, and Sb2Se3 close to ambient pressure. Our enthalpy calculations at 0 K show that at ambient pressure the R3m (tetradymite-like) ...
Monteseguro, V.; Rathaiah, M.; Linganna, K.; Lozano-Gorrin, A. D.; Hernandez-Rodriguez, M. A.; Martin, I. R.; Babu, P.; Rodriguez-Mendoza, U. R.; Manjón, Francisco-Javier; Muñoz, A.; Jayasankar, C. K.; Venkatramu, V.; Lavin, V.(The Optical Society, 2015-08-01)
[EN] Nd3+-doped RE3Ga5O12 (RE = Gd, Y, and Lu) nano-crystalline
garnets of 40-45 nm in size have been synthesized by a sol-gel method.
With the decrease of the RE atom size, the chemical pressure related to the
decreasing ...
The compression process in the α-phase of europium trimolybdate was revised employing
several experimental techniques. X-ray diffraction (using synchrotron and laboratory radiation
sources), Raman scattering and ...
[EN] We report a joint experimental and theoretical study of the structural and vibrational properties of C-type bulk Y2O3 under hydrostatic compression. The combination of high-pressure X-ray diffraction and Raman scattering ...
Marí-Guaita, Julia; Gallego-Parra, Samuel; Sans-Tresserras, Juan Ángel; Velázquez, M.; Veber, Phillipe; Rodríguez-Hernández, P.; Manjón, Francisco-Javier; Muñoz, A.(Elsevier, 2021-08-05)
[EN] In this study, we report an experimental investigation of (Gd1-xYbx)(2)O-3 under high pressure by means of Raman scattering measurements complemented with ab initio calculations in pure Gd2O3. Raman spec-troscopy of ...
[EN] Optical absorption measurements at high pressure have been performed in two phases of the ordered -vacancy compound (OVC) ZnGa2Se4: defect stannite (DS) and defect chalcopyrite (DC). The direct bandgap energy of both ...
[EN] High-pressure synchrotron X-ray diffraction studies of cobalt iodate, Co(IO3)(2), reveal a counterintuitive pressure-induced expansion along certain crystallographic directions. High-pressure Raman and infrared ...
[EN] The structural and vibrational behavior of Mg(IO3)(2) under compression has been investigated via a combination of high-pressure (HP) synchrotron x-ray diffraction (XRD), Raman scattering, and infrared spectroscopy ...
Gallego-Parra, Samuel; Vilaplana Cerda, Rosario Isabel; Gomis, O.; Lora da Silva, E.; Otero-de-la-Roza, A.; Rodríguez-Hernández, P.; Muñoz, A.; González, J.; Sans-Tresserras, Juan Ángel; Cuenca-Gotor, Vanesa Paula; Ibáñez, J.; Popescu, C.; Manjón, Francisco-Javier(The Royal Society of Chemistry, 2021-03-21)
[EN] We report a joint experimental and theoretical study of the low-pressure phase of ¿¿-Ga2S3 under compression. Theoretical ab initio calculations have been compared to X-ray diffraction and Raman scattering measurements ...