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Dependence of phonon widths on pressure and isotopic mass: ZnO
Conference ObjectAbstract: Considerable attention has been devoted recently to the dependence of the widths of the Raman phononPalabras claves:Autores:Cardona M., Jorge Serrano, Lauck R., Romero A.H., Rubio A., Widulle F.Fuentes:scopusFirst-principles study of electronic, vibrational, elastic, and magnetic properties of FeF <inf>2</inf> as a function of pressure
ArticleAbstract: We report systematic ab initio calculations of the electronic band structure, phonon dispersion relaPalabras claves:Autores:José Mejía-López, López-Moreno S., Muñoz A., Romero A.H., Roshchin I.V.Fuentes:scopusEffect of pressure on the Raman scattering of wurtzite AlN
Conference ObjectAbstract: High-pressure Raman spectra of wurtzite aluminum nitride were measured up to 25 GPa. The Raman-activPalabras claves:Autores:Errandonea D., Garro N., Jorge Serrano, Kuball M., Manjón F.J., Romero A.H.Fuentes:scopusEffect of sulphur doping on manganese clusters: An ab initio study
ArticleAbstract: We report a structural, electronic and magnetic analysis of minimal Mn nS clusters, n = 1-13, from aPalabras claves:Autores:José Mejía-López, Pinto J., Romero A.H.Fuentes:scopusMonoatomic and dimer Mn adsorption on the Au(111) surface from first principles
ArticleAbstract: A theoretical study based on the density functional theory of the adsorption of Mn monomers and dimePalabras claves:Autores:José Mejía-López, Morán-López J.L., Munoz F., Romero A.H.Fuentes:scopusHeat capacity of PbS: Isotope effects
ArticleAbstract: In recent years, the availability of highly pure stable isotopes has made possible the investigationPalabras claves:Autores:Cardona M., Jorge Serrano, Kremer R.K., Lauck R., Romero A.H., Siegle G.Fuentes:scopusPhysical and chemical characterization of Pt<inf>12-n</inf> Cu<inf>n</inf> clusters via ab initio calculations
ArticleAbstract: The physical, structural, and chemical properties of bimetallic Pt 12-n Cun clusters, where n goes fPalabras claves:Autores:García G., José Mejía-López, Romero A.H.Fuentes:scopusLattice dynamics of wurtzite and rocksalt AlN under high pressure: Effect of compression on the crystal anisotropy of wurtzite-type semiconductors
ArticleAbstract: Raman spectra of aluminum nitride (AlN) under pressure have been measured up to 25 GPa, i.e., beyondPalabras claves:Autores:Errandonea D., Garro N., Jorge Serrano, Kuball M., Manjón F.J., Romero A.H.Fuentes:scopusLattice properties of PbX (X=S, Se, Te): Experimental studies and ab initio calculations including spin-orbit effects
ArticleAbstract: During the past five years the low-temperature heat capacity of simple semiconductors and insulatorsPalabras claves:Autores:Cardona M., Gonze X.C., Jorge Serrano, Kremer R.K., Lauck R., Romero A.H., Siegle G.Fuentes:scopusUnderstanding the elusive magnetic behavior of manganese clusters
ArticleAbstract: Manganese is a multifarious element and presents a large variety of behaviors. With the aim of underPalabras claves:Autores:Garcia M.E., José Mejía-López, Morán-López J.L., Romero A.H.Fuentes:scopus