7.7k citations
Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.
- Scuola Normale SuperioreIT710 papers
- National Enterprise for NanoScience and NanoTechnologyIT581 papers
- University of Modena and Reggio EmiliaIT183 papers
- Italian Institute of TechnologyIT173 papers
- University of PisaIT153 papers
- Centre National de la Recherche ScientifiqueFR129 papers
- Superconducting and other Innovative Materials and Devices InstituteIT96 papers
- The Abdus Salam International Centre for Theoretical Physics (ICTP)IT81 papers
- Istituto Nazionale di Fisica Nucleare, Sezione di PisaIT69 papers
- National Research CouncilLK68 papers
- University of PalermoIT68 papers
- Center for Nanotechnology InnovationIT65 papers
9 papers · 2 filters
Donor and acceptor levels of organic photovoltaic compounds from first principles
Ismaila Dabo, Andrea Ferretti, Cheol-Hwan Park +4
Accurate and efficient approaches to predict the optical properties of organic semiconducting compounds could accelerate the search for efficient organic photovoltaic materials. Ne…
Optimal Energy Dissipation in Sliding Friction Simulations
A. Benassi, A. Vanossi, G. E. Santoro +1
Non-equilibrium molecular dynamics simulations, of crucial importance in sliding friction, are hampered by arbitrariness and uncertainties in the removal of the frictionally genera…
K-edge X-ray absorption spectra in transition metal oxides beyond the single particle approximation: shake-up many body effects
M. Calandra, J. P. Rueff, C. Gougoussis +7
The near edge structure (XANES) in K-edge X-ray absorption spectroscopy (XAS) is a widely used tool for studying electronic and local structure in materials. The precise interpreta…
Ab initio complex band structure of conjugated polymers: Effects of hydrid DFT and GW schemes
Andrea Ferretti, Giuseppe Mallia, Layla Martin-Samos +4
The non-resonant tunneling regime for charge transfer across nanojunctions is critically dependent on the so-called β parameter, governing the exponential decay of the current as t…
Raman Spectroscopy of magneto-phonon resonances in Graphene and Graphite
Sarah Goler, Jun Yan, Vittorio Pellegrini +1
The magneto-phonon resonance or MPR occurs in semiconductor materials when the energy spacing between Landau levels is continuously tuned to cross the energy of an optical phonon m…
Designing all-graphene nanojunctions by covalent functionalization
Caterina Cocchi, Alice Ruini, Deborah Prezzi +2
We investigated theoretically the effect of covalent edge functionalization, with organic functional groups, on the electronic properties of graphene nanostructures and nano-juncti…
Optical Excitations and Field Enhancement in Short Graphene Nanoribbons
Caterina Cocchi, Deborah Prezzi, Alice Ruini +4
The optical excitations of elongated graphene nanoflakes of finite length are investigated theoretically through quantum chemistry semi-empirical approaches. The spectra and the re…
Precise Determination of Minimum Achievable Temperature for Solid-State Optical Refrigeration
Denis V. Seletskiy, Seth D. Melgaard, Richard I. Epstein +3
We measure the minimum achievable temperature (MAT) as a function of excitation wavelength in anti-Stokes fluorescence cooling of high purity Yb3+-doped LiYF4 (Yb:YLF) crystal. Suc…
The bandstructure of gold from many-body perturbation theory
T. Rangel, D. Kecik, P. E. Trevisanutto +3
The bandstructure of gold is calculated using many-body perturbation theory (MBPT). Different approximations within the GW approach are considered. Standard single shot G0W0 correc…