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Titolo Data di pubblicazione Autore(i) File
STRAIN AND ALLOYING EFFECTS ON THE ELECTRONIC AND VIBRATIONAL PROPERTIES OF INYAL1-YAS ON INP 1-gen-1995 Pavesi, L; Houdre, R; Giannozzi, Paolo
MOLECULAR-STRUCTURE AND CHEMICAL BONDING IN K3C60 AND K6C60 1-gen-1995 Andreoni, W; Giannozzi, Paolo; Parrinello, M.
Isolation, structure, and electronic calculations of the heterofullerene salt K6C59N 1-gen-1996 Prassides, K; Keshavarzk, M; Hummelen, Jc; Andreoni, W; Giannozzi, Paolo; Beer, E; Bellavia, C; Cristofolini, L; Gonzalez, R; Lappas, A; Murata, Y; Malecki, M; Srdanov, V; Wudl, F.
Anomalous electronic behaviour of Na superfullerides: Theory and experiment 1-gen-1996 Andreoni, W; Giannozzi, Paolo; Armbruster, Jf; Knupfer, M; Fink, J.
Effects of doping on the vibrational properties of C-60 from first principles: K6C60 1-gen-1996 Giannozzi, Paolo; Andreoni, W.
Raman cross section for the pentagonal-pinch mode in buckminsterfullerene C-60 1-gen-1997 Lorentzen, Jd; Guha, S; Menendez, J; Giannozzi, Paolo; Baroni, S.
Structure, kinetics, and passivation of hydrogen-acceptor complexes in gallium arsenide: A theoretical study 1-gen-1998 Bonapasta, Aa; Capizzi, M; Giannozzi, Paolo
Near-edge states induced by hydrogen inclusion in gallium arsenide 1-gen-1998 Bonapasta, Aa; Capizzi, M; Giannozzi, Paolo
Hydrogen-induced states near the GaAs band edges 1-gen-1999 Bonapasta, Aa; Capizzi, M; Giannozzi, Paolo
Microscopic structure of the substitutional Al defect in alpha quartz 1-gen-2000 Magagnini, M; Giannozzi, Paolo; Dal Corso, A.
Structural and electronic properties of C60 and C60 derivatives in the solid phases: calculations based on density-functional theory 1-gen-2000 W., Andreoni; Giannozzi, Paolo
Effects of strain and local charge on the formation of deep defects in III-V ternary alloys 1-gen-2000 Bonapasta, Aa; Giannozzi, Paolo
Theory of the metal-nonmagnetic Mott-Jahn-Teller insulator transition in A(4)C(60) 1-gen-2000 Capone, M; Fabrizio, M; Giannozzi, Paolo; Tosatti, E.
Density functional theory study of the structure and C-13 chemical shifts of retinylidene iminium salts 1-gen-2000 Buda, F; Giannozzi, Paolo; Mauri, F.
Coverage-dependent adsorption of CH3S and (CH3S)(2) on Au(111): A density functional theory study 1-gen-2001 Vargas, Mc; Giannozzi, Paolo; Selloni, A; Scoles, G.
Defect engineering in III-V ternary alloys: effects of strain and local charge on the formation of substitutional and interstitial native defects 1-gen-2001 Bonapasta, Aa; Giannozzi, Paolo
Phonons and related crystal properties from density-functional perturbation theory 1-gen-2001 Baroni, S; de Gironcoli, S; Dal Corso, A; Giannozzi, Paolo
Reconstruction of frozen-core all-electron orbitals from pseudo-orbitals 1-gen-2001 Hetenyi, B; De Angelis, F; Giannozzi, Paolo; Car, R.
Defect engineering in III-V ternary alloys: Effects of strain and local charge on the formation of native deep defects 1-gen-2002 Bonapasta, Aa; Giannozzi, Paolo
Structure and passivation effects of mono- and dihydrogen complexes in GaAsyN(1-y) alloys. 1-gen-2002 Bonapasta A., Amore; Filippone, F; Giannozzi, Paolo; Capizzi, M; Polimeni, A.
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