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List of works by Alice Ruini

Ab Initio Exploration of Rearrangement Reactions: Intramolecular Hydrogen Scrambling Processes in Acetone

scientific article published on 01 December 2006

Ab Initio Molecular Dynamics Study of the Keto–Enol Tautomerism of Acetone in Solution

article

Ab Initio Study of Chemisorption Reactions for Carboxylic Acids on Hydrogenated Silicon Surfaces

article

Ab initio simulation of optical limiting: the case of metal-free phthalocyanine. ⬇️

scientific article published on 15 May 2014

Ab initiocomplex band structure of conjugated polymers: Effects of hydrid density functional theory andGWschemes

scholarly article in Physical Review B, vol. 85 no. 23, June 2012

Anchor Group versus Conjugation: Toward the Gap-State Engineering of Functionalized ZnO(101̅0) Surface for Optoelectronic Applications ⬇️

scientific article published on March 28, 2011

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

scientific article published on 17 July 2014

Bandgap Engineering of Graphene Nanoribbons by Control over Structural Distortion

scientific article published on 15 June 2018

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

article

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

Concavity Effects on the Optical Properties of Aromatic Hydrocarbons

Designing All-Graphene Nanojunctions by Covalent Functionalization

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

Exciton-dominated optical response of ultra-narrow graphene nanoribbons

scientific article published on 8 July 2014

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

scientific article published on 12 May 2004

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

article

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

article

Hydration of cyanin dyes.

scientific article published in March 2010

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

article

Mixing of Electronic States in Pentacene Adsorption on Copper

scientific article published in Physical Review Letters

Optical Excitations and Field Enhancement in Short Graphene Nanoribbons

scientific article published on 16 March 2012

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

scientific article published on 16 May 2011

Optical Properties of Bilayer Graphene Nanoflakes

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

scientific article (publication date: 7 January 2008)

Optoelectronic properties of natural cyanin dyes.

scientific article published in July 2009

Oxygen-mediated electron transport through hybrid silicon–organic interfaces

scientific article published on 02 June 2008

Probing optical excitations in chevron-like armchair graphene nanoribbons

scientific article published on 16 November 2017

Publisher's Note: Optical properties of graphene nanoribbons: The role of many-body effects [Phys. Rev. B 77, 041404(R) (2008)]

scholarly article in Physical Review B, vol. 77 no. 4, January 2008

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

scholarly article in Physical Review B, vol. 84 no. 4, July 2011

Raman Fingerprints of Atomically Precise Graphene Nanoribbons

scientific article

Symmetry lowering of pentacene molecular states interacting with a Cu surface

scholarly article in Physical Review B, vol. 76 no. 24, December 2007

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

scholarly article in Physical Review B, vol. 72 no. 24, December 2005

Unraveling effects of disorder on the electronic structure ofSiO2from first principles

scholarly article in Physical Review B, vol. 81 no. 8, February 2010

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

scientific article published on 30 September 2020

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