List of works - Giovanni Onida

ABINIT: First-principles approach to material and nanosystem properties

article by Xavier Gonze et al published December 2009 in Computer Physics Communications

Ab Initio Spectroscopic Investigation of Pharmacologically Relevant Chiral Molecules: The Cases of Avibactam, Cephems, and Idelalisib as Benchmarks for Antibiotics and Anticancer Drugs

scientific article published in 2021

Ab initio calculations of the quasiparticle and absorption spectra of clusters: The sodium tetramer

scientific article published on 01 July 1995

Ab initio molecular dynamics of C70. Intramolecular vibrations and zero-point motion effects

article

Ab initio optical properties of BN in the cubic and in the layered hexagonal phase

Ab initioelectronic structure, optical, and magneto-optical properties of MnGaAs digital ferromagnetic heterostructures ⬇️

scholarly article in Physical Review B, vol. 91 no. 7, February 2015

Accuracy of dielectric-dependent hybrid functionals in the prediction of optoelectronic properties of metal oxide semiconductors: A comprehensive comparison with many-body GW and experiments.

scientific article published on 31 October 2017

Atomistic study of the structural and electronic properties of a-Si:H/c-Si interfaces

scientific article published on 12 February 2014

Bulk and surface dynamics of graphite with the bond charge model

scientific article published on 01 June 1993

Carbon sp chains in graphene nanoholes

scientific article published on 21 February 2012

Comment on "Charge-density wave and superconducting dome in TiSe2 from electron-phonon interaction"

scientific article published on 27 January 2014

Communication: Hole localization in Al-doped quartz SiO2 within ab initio hybrid-functional DFT ⬇️

scientific article published on 01 September 2015

Conformational dependence of the circular dichroism spectra of single amino acids from plane-waves-based density functional theory calculations.

scientific article published on 27 March 2015

Defect calculations in semiconductors through a dielectric-dependent hybrid DFT functional: The case of oxygen vacancies in metal oxides ⬇️

scientific article published on 01 October 2015

Double excitations in correlated systems: a many–body approach

scientific article published in January 2011

Double excitations in finite systems.

scientific article published in January 2009

Dynamical properties and related optical spectra of fullerenes: The bond-charge-model description

scientific article published on 01 September 1994

Dynamical response function in sodium and aluminum from time-dependent density-functional theory

article

Dynamical response function in sodium studied by inelastic x-ray scattering spectroscopy

article

Effect of Axial Torsion onspCarbon Atomic Wires

scientific article published in Physical Review Letters

Electronic States of Silicene Allotropes on Ag(111).

scientific article published on 29 December 2016

Electronic excitations: density-functional versus many-body Green’s-function approaches

scientific article

Elementary structural building blocks encountered in silicon surface reconstructions

scientific article published on 01 December 2008

Excitonic effects in solids described by time-dependent density-functional theory

scientific article published on 25 January 2002

Fingerprints of sp¹ Hybridized C in the Near-Edge X-ray Absorption Spectra of Surface-Grown Materials

scientific article published on 15 December 2018

First Principles Study of a New Large-Gap Nonoporous Silicon Crystal: Hex-Si40

scientific article published on 01 October 1996

First-principles study of silicon nanocrystals: structural and electronic properties, absorption, emission, and doping

scientific article published in February 2008

GeV complexes for silicon-based room-temperature single-atom nanoelectronics

scientific article published in Scientific Reports

Long-range contribution to the exchange-correlation kernel of time-dependent density functional theory

scholarly article in Physical Review B, vol. 69 no. 15, April 2004

Multiphotonk-resolved photoemission from gold surface states with 800-nm femtosecond laser pulses

scholarly article in Physical Review B, vol. 90 no. 3, July 2014

New structural model for the si(331)-(12x1) surface reconstruction

scientific article published on 09 February 2009

Oxidation of carbynes: signatures in infrared spectra.

scientific article published in June 2014

Quantum Spin Transport in Carbon Chains

scientific article published on 01 September 2010

Quasiparticle band-structure effects on thedhole lifetimes of copper within theGWapproximation

article

Quasiparticle electronic structure of copper in the GW approximation

scientific article published on 19 December 2001

Scanning tunneling microscopy and Raman spectroscopy of polymeric sp-sp2 carbon atomic wires synthesized on the Au(111) surface

scientific article published on 01 October 2019

Structural and Optical Properties of the Ge(111)-(2×1) Surface

scientific article published in Physical Review Letters

Synthesis, Characterization, and Modeling of Naphthyl-Terminated sp Carbon Chains: Dinaphthylpolyynes ⬇️

scientific article published on October 25, 2010

The ETSF: An e-Infrastructure That Bridges Simulations and Experiments

Valence band structure of the Si(331)-(12 × 1) surface reconstruction

scientific article published on 14 March 2011

Vibrational characterization of dinaphthylpolyynes: a model system for the study of end-capped sp carbon chains

scientific article published on 01 November 2011

List of works by Giovanni Onida

ABINIT: First-principles approach to material and nanosystem properties

Ab Initio Spectroscopic Investigation of Pharmacologically Relevant Chiral Molecules: The Cases of Avibactam, Cephems, and Idelalisib as Benchmarks for Antibiotics and Anticancer Drugs

Ab initio calculations of the quasiparticle and absorption spectra of clusters: The sodium tetramer

Ab initio molecular dynamics of C70. Intramolecular vibrations and zero-point motion effects

Ab initio optical properties of BN in the cubic and in the layered hexagonal phase

Ab initioelectronic structure, optical, and magneto-optical properties of MnGaAs digital ferromagnetic heterostructures ⬇️

Accuracy of dielectric-dependent hybrid functionals in the prediction of optoelectronic properties of metal oxide semiconductors: A comprehensive comparison with many-body GW and experiments.

Atomistic study of the structural and electronic properties of a-Si:H/c-Si interfaces

Bulk and surface dynamics of graphite with the bond charge model

Carbon sp chains in graphene nanoholes

Comment on "Charge-density wave and superconducting dome in TiSe2 from electron-phonon interaction"

Communication: Hole localization in Al-doped quartz SiO2 within ab initio hybrid-functional DFT ⬇️

Conformational dependence of the circular dichroism spectra of single amino acids from plane-waves-based density functional theory calculations.

Defect calculations in semiconductors through a dielectric-dependent hybrid DFT functional: The case of oxygen vacancies in metal oxides ⬇️

Double excitations in correlated systems: a many–body approach

Double excitations in finite systems.

Dynamical properties and related optical spectra of fullerenes: The bond-charge-model description

Dynamical response function in sodium and aluminum from time-dependent density-functional theory

Dynamical response function in sodium studied by inelastic x-ray scattering spectroscopy

Effect of Axial Torsion onspCarbon Atomic Wires

Electronic States of Silicene Allotropes on Ag(111).

Electronic excitations: density-functional versus many-body Green’s-function approaches

Elementary structural building blocks encountered in silicon surface reconstructions

Excitonic effects in solids described by time-dependent density-functional theory

Fingerprints of sp¹ Hybridized C in the Near-Edge X-ray Absorption Spectra of Surface-Grown Materials

First Principles Study of a New Large-Gap Nonoporous Silicon Crystal: Hex-Si40

First-principles study of silicon nanocrystals: structural and electronic properties, absorption, emission, and doping

GeV complexes for silicon-based room-temperature single-atom nanoelectronics

Long-range contribution to the exchange-correlation kernel of time-dependent density functional theory

Multiphotonk-resolved photoemission from gold surface states with 800-nm femtosecond laser pulses

New structural model for the si(331)-(12x1) surface reconstruction

Oxidation of carbynes: signatures in infrared spectra.

Quantum Spin Transport in Carbon Chains

Quasiparticle band-structure effects on thedhole lifetimes of copper within theGWapproximation

Quasiparticle electronic structure of copper in the GW approximation

Scanning tunneling microscopy and Raman spectroscopy of polymeric sp-sp2 carbon atomic wires synthesized on the Au(111) surface

Structural and Optical Properties of the Ge(111)-(2×1) Surface

Synthesis, Characterization, and Modeling of Naphthyl-Terminated sp Carbon Chains: Dinaphthylpolyynes ⬇️

The ETSF: An e-Infrastructure That Bridges Simulations and Experiments

Valence band structure of the Si(331)-(12 × 1) surface reconstruction

Vibrational characterization of dinaphthylpolyynes: a model system for the study of end-capped sp carbon chains

Vibrational properties of sp carbon atomic wires in cluster-assembled carbon films