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1ST-PRINCIPLES CALCULATION OF THE VIBRATIONAL PROPERTIES OF GAXAL1-XAS ALLOYS 1-gen-1990 BARONI, SDE GIRONCOLI, SGIANNOZZI, P
Piezoelectricity in III-V and II-VI semiconductors: A systematic ab-initio calculation 1-gen-1990 De Gironcoli, S.Baroni, S.Resta, R.
Cation interdiffusion in GaAs‐AlAs superlattices measured with Raman spectroscopy 1-gen-1991 Baroni, S. +
Structure and thermodynamics of SixGe1−x alloys from ab initio Monte Carlo simulations 1-gen-1991 De Gironcoli, S.Giannozzi, P.Baroni, S.
Surface phonons and dipole activity of Si(111)2×1 from ab initio calculations 1-gen-1991 Baroni, Stefano +
Valence-band offsets at strained Si/Ge interfaces 1-gen-1991 Resta, R.Baroni, S. +
Phonon Spectra of Ultrathin GaAs/AlAs Superlattices 1-gen-1991 Baroni, S.De Gironcoli, S. +
Ab initio calculation of phonon dispersions in semiconductors 1-gen-1991 Giannozzi, P.De Gironcoli, S.Baroni, S. +
Infrared reflectivity by transverse-optical phonons in (GaAs)m/(AlAs)n ultrathin-layer superlattices 1-gen-1991 Baroni, S.Giannozzi, P.De Gironcoli, S. +
Control of Ge homojunction band offsets via ultrathin Ga–As dipole layers 1-gen-1991 Baroni, S.Resta, R. +
Tuning band offsets at semiconductor interfaces by intralayer deposition 1-gen-1991 Baroni, S. +
Control of Ge homojunction band offsets via ultrathin GaAs dipole layers 1-gen-1992 Baroni, S.Resta, R. +
Microscopic manipulation of homojunction band lineups 1-gen-1992 Baroni, S.Resta, R. +
Phonon softening and high-pressure low-symmetry phases of cesium iodide 1-gen-1992 Baroni, SGiannozzi, P. +
Towards Very Large-Scale Electronic-Structure Calculations 1-gen-1992 Baroni, SGiannozzi, P.
Effects of disorder on the vibrational properties of sige alloys: Failure of mean-field approximations 1-gen-1992 De Gironcoli, S.Baroni, S.
Vibrational properties of isolated AlAs monolayers embedded in GaAs: a theoretical study of the effects of disorder 1-gen-1992 Baroni, S.Giannozzi, P.de Gironcoli, S. +
Structure and Thermodynamics of SiGe Alloys from Computational Alchemy 1-gen-1992 Baroni, S.De Gironcoli, S.Giannozzi, P.
Microscopic capacitors and neutral interfaces in III-V/IV/III-V semiconductor heterostructures 1-gen-1992 Baroni, S.Resta, R. +
Effects of disorder on the Raman spectra of GaAs/AlAs superlattices 1-gen-1992 Baroni, S.Giannozzi, P.De Gironcoli, S. +
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