A. Ruini

发表

Excitons in carbon nanotubes: an ab initio symmetry-based approach.

E. Chang, G. Bussi, A. Ruini, 2004, Physical review letters.

Oxygen deficient centers in silica: optical properties within many-body perturbation theory

A. Ruini, S. Girard, J. Meunier, 2013, Journal of physics. Condensed matter : an Institute of Physics journal.

Accurate ab initio tight-binding Hamiltonians: Effective tools for electronic transport and optical spectroscopy from first principles

Luis A. Agapito, A. Catellani, A. Calzolari, 2016, 1608.05685.

Electronic Supplementary Material (ESI) for: Optoelectronic properties and color chemistry of native point defects in Al:ZnO transparent conductive oxide

Arrigo Calzolari, Alessandra Catellani, A. Catellani, 2015 .

Spectroscopic identification of the chemical interplay between defects and dopants in Al-doped ZnO.

A. Calzolari, A. Ruini, P. Torelli, 2017, Physical Chemistry, Chemical Physics - PCCP.

Quantum-dot states and optical excitations in edge-modulated graphene nanoribbons

D. Varsano, A. Ruini, E. Molinari, 2011, 1104.3519.

Nitrocatechol/ZnO Interface: The Role of Dipole in a Dye/Metal-Oxide Model System

A. Catellani, A. Calzolari, A. Ruini, 2014 .

Surface nanopatterning through styrene adsorption on Si(100)

A. Calzolari, A. Ruini, E. Molinari, 2005, cond-mat/0507635.

Relationship between structural and optoelectronic properties in semiconducting polymers

A. Ferretti, G. Bussi, A. Ruini, 2004 .

Exciton binding energies in carbon nanotubes from two-photon photoluminescence

J. Maultzsch, S. Reich, C. Thomsen, 2005, cond-mat/0505150.

Substitutional Impurities in PPV Crystals: An Intrinsic Donor−Acceptor System for High VOC Photovoltaic Devices

C. Cavazzoni, A. Calzolari, A. Ruini, 2010 .

Interchain interaction and Davydov splitting in polythiophene crystals: An ab initio approach

C. Ambrosch-Draxl, G. Bussi, A. Ruini, 2002 .

Solid state effects on exciton states and optical properties of PPV.

G. Bussi, A. Ruini, E. Molinari, 2002, Physical review letters.

Numerically Precise Benchmark of Many-Body Self-Energies on Spherical Atoms

A. Ferretti, D. Varsano, A. Ruini, 2022, Journal of chemical theory and computation.

Excitons in carbon nanotubes: an ab initio symmetry-based approach.

E. Chang, G. Bussi, A. Ruini, 2004, Physical review letters.

Dynamical-charge neutrality at a crystal surface

S. Baroni, A. Ruini, R. Resta, 1997, cond-mat/9701194.

Ab initio molecular dynamics study of the keto-enol tautomerism of acetone in solution.

A. Catellani, A. Ruini, A. Stirling, 2006, Chemphyschem : a European journal of chemical physics and physical chemistry.

New energy with ZnS: novel applications for a standard transparent compound

A. Catellani, A. Calzolari, A. Ruini, 2017, Scientific Reports.

Nonlinear light absorption in many-electron systems excited by an instantaneous electric field: a non-perturbative approach.

C. Rozzi, A. Ruini, C. Cocchi, 2020, Physical chemistry chemical physics : PCCP.

Nonlinear Response of a Quantum System to Impulsive Perturbations: A Non-Perturbative Real-Time Approach

C. Rozzi, A. Ruini, C. Cocchi, 2020, 2004.06973.

Charge transport and radiative recombination in polythiophene crystals: a first-principles study

A. Ferretti, G. Bussi, A. Ruini, 2003 .

Hydration of cyanin dyes.

A. Catellani, A. Calzolari, A. Ruini, 2010, The Journal of chemical physics.

Electronics and Optics of Graphene Nanoflakes: Edge Functionalization and Structural Distortions

A. Ruini, E. Molinari, C. Cocchi, 2012, 1208.4228.

Competitive Chemisorption of Bifunctional Carboxylic Acids on H:Si(100): A First-Principles Study

A. Catellani, A. Ruini, E. Molinari, 2008 .

Optical Properties and Charge-Transfer Excitations in Edge-Functionalized All-Graphene Nanojunctions.

A. Ruini, E. Molinari, C. Cocchi, 2011, The journal of physical chemistry letters.

Raman Fingerprints of Atomically Precise Graphene Nanoribbons

A. Ferrari, C. Casiraghi, A. Ruini, 2016, Nano letters.

Designing all-graphene nano-junctions by covalent functionalization

A. Ruini, E. Molinari, C. Cocchi, 2011, 1203.6568.

Mixing of electronic states in pentacene adsorption on copper.

Arrigo Calzolari, Rosa Di Felice, Elisa Molinari, 2007, Physical review letters.

SiO2 in density functional theory and beyond

A. Ruini, E. Molinari, L. Martin-Samos, 2011 .

Multiwavelength Raman spectroscopy of ultranarrow nanoribbons made by solution-mediated bottom-up approach

Daniel J. Rizzo, C. Casiraghi, A. Ruini, 2019, Physical Review B.

Excitons in carbon nanotubes

J. Maultzsch, S. Reich, C. Thomsen, 2006 .

Two‐photon photoluminescence and exciton binding energies in single‐walled carbon nanotubes

J. Maultzsch, S. Reich, C. Thomsen, 2006 .

First-principles approach for the calculation of optical properties of one-dimensional systems with helical symmetry: The case of carbon nanotubes

E. Chang, G. Bussi, A. Ruini, 2005 .

Optical Properties of Bilayer Graphene Nanoflakes

A. Ruini, E. Molinari, C. Cocchi, 2014 .

Anisotropy and size effects on the optical spectra of polycyclic aromatic hydrocarbons.

A. Ruini, E. Molinari, C. Cocchi, 2014, The journal of physical chemistry. A.

Optical Excitations and Field Enhancement in Short Graphene Nanoribbons.

A. Ruini, E. Molinari, C. Cocchi, 2012, The journal of physical chemistry letters.

Exciton-dominated optical response of ultra-narrow graphene nanoribbons

A. Ferretti, A. Ruini, E. Molinari, 2014, Nature Communications.

Optical properties of one‐dimensional graphene polymers: the case of polyphenanthrene

D. Varsano, A. Ruini, E. Molinari, 2007 .

Optical properties of graphene nanoribbons: The role of many-body effects

A. Marini, D. Varsano, A. Ruini, 2007, 0706.0916.

Ab initio study of transport parameters in polymer crystals

A. Ferretti, G. Bussi, A. Ruini, 2004 .

Electronic properties of polymer crystals: the effect of interchain interactions.

A. Ferretti, A. Ruini, E. Molinari, 2003, Physical review letters.

Thermoelectric figure of merit of polymeric systems for low-power generators

A. Catellani, A. Calzolari, A. Ruini, 2017 .

Density functional approach to the band gaps of finite and periodic two-dimensional systems

C. Rozzi, A. Ruini, S. Pittalis, 2021, Physical Review B.

Band Structure Modulation by Methoxy-Functionalization of Graphene Nanoribbons

A. Ruini, E. Molinari, A. Narita, 2022, Journal of Materials Chemistry C.

A first-principles study of self-healing binders for next-generation Si-based lithium-ion batteries

A. Ruini, E. Degoli, R. Magri, 2023, Materials Today Chemistry.

Ab-initio study of Coulomb-correlated optical properties in conjugated polymers

F. Rossi, R. Capaz, A. Ruini, 2001 .

First-principles investigation of functionalization-defects on silicon surfaces

A. Ferretti, B. Bonferroni, A. Ruini, 2006 .

Excitonic effects in graphene-like C$_3$N

A. Ferretti, D. Varsano, A. Ruini, 2022, 2204.11105.

Transparent Conductive Oxides as Near-IR Plasmonic Materials: The Case of Al-Doped ZnO Derivatives

Arrigo Calzolari, Alessandra Catellani, A. Catellani, 2014 .

Hybridized electronic states between CdSe nanoparticles and conjugated organic ligands: A theoretical and ultrafast photo-excited carrier dynamics study

A. Catellani, A. Calzolari, A. Ruini, 2017, Nano Research.

Charge Separation in the Hybrid CdSe Nanocrystal–Organic Interface: Role of the Ligands Studied by Ultrafast Spectroscopy and Density Functional Theory

A. Catellani, A. Calzolari, A. Ruini, 2013 .

Structural and Dynamic Characterization of Li–Ionic Liquid Electrolyte Solutions for Application in Li-Ion Batteries: A Molecular Dynamics Approach

A. Ruini, E. Degoli, R. Magri, 2023, Batteries.

Symmetry lowering of pentacene molecular states interacting with a Cu surface

A. Ferretti, A. Calzolari, R. Felice, 2007 .

Bandgap Engineering of Graphene Nanoribbons by Control over Structural Distortion.

A. Ruini, E. Molinari, Juan Li, 2018, Journal of the American Chemical Society.

Ab‐initio study of excitonic effects in conventional and organic semiconductors

Giovanni Bussi, Claudia Ambrosch-Draxl, Niels Egede Christensen, 2005 .

Fluorine-Induced Enhancement of the Oxidation Stability and Deep-Blue Optical Activity in Conductive Polyfluorene Derivatives

A. Calzolari, A. Ruini, M. Pasini, 2013 .

Ab initio Optical Absorption in Conjugated Polymers: the Role of Dimensionality

A. Ruini, 2004 .

Conflicting effect of chemical doping on the thermoelectric response of ordered PEDOT aggregates.

A. Catellani, A. Calzolari, A. Ruini, 2018, Physical chemistry chemical physics : PCCP.

Concavity Effects on the Optical Properties of Aromatic Hydrocarbons

A. Ruini, E. Molinari, C. Cocchi, 2013, 1306.2766.

Ab initio complex band structure of conjugated polymers: Effects of hydrid density functional theory and GW schemes

Giovanni Bussi, Layla Martin-Samos, Giuseppe Mallia, 2012, 1205.3282.

Excited states in low-dimensional systems

G. Bussi, A. Ruini, 2005 .

Anchor group versus conjugation: toward the gap-state engineering of functionalized ZnO(1010) surface for optoelectronic applications.

A. Catellani, A. Calzolari, A. Ruini, 2011, Journal of the American Chemical Society.

Surface Effects on Catechol/Semiconductor Interfaces

A. Catellani, A. Calzolari, A. Ruini, 2012 .

Tailoring the electronic properties of silicon with cysteine: A first-principles study

A. Catellani, A. Ruini, C. Cucinotta, 2005 .

Vibrational signature of the graphene nanoribbon edge structure from high-resolution electron energy-loss spectroscopy.

A. Ruini, E. Molinari, K. Müllen, 2020, Nanoscale.

Quenching of low-energy optical absorption in bilayer C3N polytypes

D. Varsano, A. Ruini, E. Molinari, 2023, Physical Review Materials.

Unconventional co-existence of plasmon and thermoelectric activity in In:ZnO nanowires

A. Catellani, A. Calzolari, M. Nardelli, 2015 .

Oxygen-mediated electron transport through hybrid silicon–organic interfaces

A. Ferretti, A. Calzolari, B. Bonferroni, 2008, Nanotechnology.