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Mostrati risultati da 1 a 50 di 115
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Structure constants in the Green's function method: a new analytic evaluation 1-gen-1983 Giannozzi, Paolo; Grosso, G; Pastori Parravicini, G.
Hartree-Fock energy bands in molecular crystals : Solid hydrogen in the cubic phase 1-gen-1984 Giannozzi, Paolo; Baroni, S.
THE CLASSICAL AND GENERALIZED MOMENT PROBLEM IN THE THEORY OF RELAXATION 1-gen-1985 Giannozzi, Paolo; Grosso, G; Parravicini, Gp
MULTIPLE-SCATTERING APPROACH TO THE PROPAGATION OF ELECTROMAGNETIC-WAVES IN HETEROGENEOUS MEDIA 1-gen-1986 Giannozzi, Paolo; Grosso, G; Parravicini, Gp
GREEN-FUNCTION APPROACH TO LINEAR RESPONSE IN SOLIDS 1-gen-1987 Baroni, S; Giannozzi, Paolo; Testa, A.
ELASTIC-CONSTANTS OF CRYSTALS FROM LINEAR-RESPONSE THEORY 1-gen-1987 Baroni, S; Giannozzi, Paolo; Testa, A.
THEORETICAL-ANALYSIS OF THE 3-K MAGNETIC-STRUCTURE AND DISTORTION OF URANIUM-DIOXIDE 1-gen-1987 Giannozzi, Paolo; Erdos, P.
PRESSURE-INDUCED STRUCTURAL INSTABILITY OF CESIUM-HALIDES FROM ABINITIO PSEUDOPOTENTIAL TECHNIQUES 1-gen-1987 Baroni, S; Giannozzi, Paolo
THE ORDINARY AND MATRIX CONTINUED FRACTIONS IN THE THEORETICAL-ANALYSIS OF HERMITIAN AND RELAXATION OPERATORS 1-gen-1988 Giannozzi, Paolo; Grosso, G; Moroni, S; Parravicini, Gp
EFFECT OF SYMMETRY AND CORRELATION OF CONDUCTION STATES ON THE INDIRECT MAGNETIC EXCHANGE 1-gen-1988 Acquarone, M; Monachesi, P; Giannozzi, Paolo
GROUND-STATE PROPERTIES OF CESIUM DIMERS FROM ABINITIO PSEUDOPOTENTIAL APPROACHES 1-gen-1989 Moullet, I; Andreoni, W; Giannozzi, Paolo
RELATIONSHIP BETWEEN ELECTRONIC CONDUCTION STATES AND INDIRECT MAGNETIC EXCHANGE 1-gen-1989 Monachesi, P; Giannozzi, Paolo; Acquarone, M.
PHONON-SPECTRA OF ULTRATHIN GAAS/ALAS SUPERLATTICES - AN ABINITIO CALCULATION 1-gen-1990 Baroni, S; Giannozzi, Paolo; Molinari, E.
AMPHOTERIC BEHAVIOR OF H0 IN GAAS 1-gen-1990 Pavesi, L; Giannozzi, Paolo; Reinhart, Fk
VIBRATIONAL FREQUENCIES OF SI-P-H COMPLEXES IN CRYSTALLINE SILICON - A THEORETICAL-STUDY 1-gen-1990 Bonapasta, Aa; Giannozzi, Paolo; Capizzi, M.
LOW-TEMPERATURE STRUCTURES OF C4 AND C10 FROM THE CAR-PARRINELLO METHOD - SINGLET-STATES 1-gen-1990 Andreoni, W; Scharf, D; Giannozzi, Paolo
THEORY OF ELECTRONIC STATES IN LATTICES AND SUPERLATTICES 1-gen-1990 Giannozzi, Paolo; Grosso, G; Parravicini, Gp
PHONON DISPERSIONS IN GAXAL1-XAS ALLOYS 1-gen-1990 Baroni, S; Degironcoli, S; Giannozzi, Paolo
STRUCTURE AND THERMODYNAMICS OF SIXGE1-X ALLOYS FROM ABINITIO MONTE-CARLO SIMULATIONS 1-gen-1991 Degironcoli, S; Giannozzi, Paolo; Baroni, S.
H PASSIVATION OF SI IMPURITIES IN GAAS 1-gen-1991 Pavesi, L; Giannozzi, Paolo
STRUCTURAL AND VIBRATIONAL PROPERTIES OF THE SI-H-AL COMPLEX IN CRYSTALLINE SILICON 1-gen-1991 Bonapasta, Aa; Giannozzi, Paolo; Capizzi, M.
ABINITIO CALCULATION OF PHONON DISPERSIONS IN SEMICONDUCTORS 1-gen-1991 Giannozzi, Paolo; DE GIRONCOLI, S; Pavone, P; Baroni, S.
INFRARED REFLECTIVITY BY TRANSVERSE-OPTICAL PHONONS IN (GAAS)M/(ALAS)N ULTRATHIN-LAYER SUPERLATTICES 1-gen-1991 Scamarcio, G; Tapfer, L; Konig, W; Fischer, A; Ploog, K; Molinari, E; Baroni, S; Giannozzi, Paolo; Degironcoli, S.
1ST PRINCIPLES CALCULATIONS OF HYDROGEN IN BULK GAAS 1-gen-1991 Pavesi, L; Giannozzi, Paolo
PHONON SOFTENING AND HIGH-PRESSURE LOW-SYMMETRY PHASES OF CESIUM IODIDE 1-gen-1992 Nardelli, Mb; Baroni, S; Giannozzi, Paolo
13-ATOM CLUSTERS - EQUILIBRIUM GEOMETRIES, STRUCTURAL TRANSFORMATIONS, AND TRENDS IN NA, MG, AL, AND SI 1-gen-1992 Rothlisberger, U; Andreoni, W; Giannozzi, Paolo
VIBRATIONAL PROPERTIES OF ISOLATED ALAS MONOLAYERS EMBEDDED IN GAAS - A THEORETICAL-STUDY OF THE EFFECTS OF DISORDER 1-gen-1992 Molinari, E; Baroni, S; Giannozzi, Paolo; Degironcoli, S.
EFFECTS OF DISORDER ON THE RAMAN-SPECTRA OF GAAS/ALAS SUPERLATTICES 1-gen-1992 Molinari, E; Baroni, S; Giannozzi, Paolo; Degironcoli, S.
ATOMIC AND MOLECULAR-HYDROGEN IN GALLIUM-ARSENIDE - A THEORETICAL-STUDY 1-gen-1992 Pavesi, L; Giannozzi, Paolo
SILICON-HYDROGEN-ACCEPTOR COMPLEXES IN CRYSTALLINE SILICON 1-gen-1992 Bonapasta, Aa; Giannozzi, Paolo; Capizzi, M.
TOWARDS VERY LARGE-SCALE ELECTRONIC-STRUCTURE CALCULATIONS 1-gen-1992 Baroni, S; Giannozzi, Paolo
2ND-ORDER RAMAN-SPECTRA OF DIAMOND FROM AB-INITIO PHONON CALCULATIONS 1-gen-1993 Windl, W; Pavone, P; Karch, K; Schutt, O; Strauch, D; Giannozzi, Paolo; Baroni, S.
AB-INITIO LATTICE-DYNAMICS OF DIAMOND 1-gen-1993 Pavone, P; Karch, K; Schutt, O; Windl, W; Strauch, D; Giannozzi, Paolo; Baroni, S.
ISOTOPICALLY RESOLVED RAMAN-SPECTRA OF C-60 1-gen-1994 Guha, S; Menendez, J; Page, Jb; Adams, Gb; Spencer, Gs; Lehman, Jp; Giannozzi, Paolo; Baroni, S.
VIBRATIONAL AND DIELECTRIC-PROPERTIES OF C-60 FROM DENSITY-FUNCTIONAL PERTURBATION-THEORY 1-gen-1994 Giannozzi, Paolo; Baroni, S.
ABSENCE OF METAL-CLUSTERS AND APPEARANCE OF NEW ELECTRON-STATES IN NA6C60 1-gen-1994 Andreoni, W; Giannozzi, Paolo; Parrinello, M.
HIGH-PRESSURE LOW-SYMMETRY PHASES OF CESIUM-HALIDES 1-gen-1995 Nardelli, Mb; Baroni, S; Giannozzi, Paolo
STRUCTURE AND BONDING IN CISPLATIN AND OTHER PT(II) COMPLEXES 1-gen-1995 Carloni, P; Andreoni, W; Hutter, J; Curioni, A; Giannozzi, Paolo; Parrinello, M.
MOLECULAR-STRUCTURE AND CHEMICAL BONDING IN K3C60 AND K6C60 1-gen-1995 Andreoni, W; Giannozzi, Paolo; Parrinello, M.
STRAIN AND ALLOYING EFFECTS ON THE ELECTRONIC AND VIBRATIONAL PROPERTIES OF INYAL1-YAS ON INP 1-gen-1995 Pavesi, L; Houdre, R; Giannozzi, Paolo
C61H2 IN MOLECULAR AND SOLID-PHASES - DENSITY-FUNCTIONAL APPROACH TO STRUCTURAL AND ELECTRONIC-PROPERTIES 1-gen-1995 Curioni, A; Giannozzi, Paolo; Hutter, J; Andreoni, W.
A FIRST-PRINCIPLES DERIVED PARAMETRIZATION FOR THE ADIABATIC BOND CHARGE MODEL 1-gen-1995 Colombo, L; Giannozzi, Paolo
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.
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.
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.
Near-edge states induced by hydrogen inclusion in gallium arsenide 1-gen-1998 Bonapasta, Aa; Capizzi, M; Giannozzi, Paolo
Structure, kinetics, and passivation of hydrogen-acceptor complexes in gallium arsenide: A theoretical study 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
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
Mostrati risultati da 1 a 50 di 115
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