Sfoglia per Autore
Nonisovalent Alloys for Photovoltaics Applications: Modelling IV-Doped III-V Alloys
2012 Giorgi, Giacomo; Kawai, Hiroki; Yamashita, Koichi
Neutron generation via the mechanism adsorption of pressurized deuterium on an electron deficient titanium matrix. An MD-DFT combined analysis on the mechanism of the Ti-D bond formation
2012 Giorgi, Giacomo; Belanzoni, Paola; Asami, T.; Yamashita, K.
The nature of radiative transitions in TiO 2-based nanosheets
2012 Palummo, Maurizia; Giorgi, Giacomo; Chiodo, Letizia; Rubio, Angel; Yamashita, Koichi
Impact of short-range order and clusterization on the bandgap bowing: First-principles calculations on the electronic properties of metastable (GaAs)1-x(Ge2)x alloys
2012 Kawai, H.; Giorgi, Giacomo; Yamashita, K.
Back Cover: Impact of short-range order and clusterization on the bandgap bowing: First-principles calculations on the electronic properties of metastable (GaAs)1-x(Ge2)x alloys (Phys. Status Solidi B 1/2012)
2012 Kawai, H.; Giorgi, Giacomo; Yamashita, K.
Minority surfaces of anatase & derived layered structures: optical signatures and functionalization in photovoltaics oriented applications
2013 Giorgi, Giacomo; Palummo, Maurizia; Chiodo, Letizia; Rubio, Angel; Fujisawa, Jun ichi; Segawa, Hiroshi; Yamashita, Koichi
Communication: Singularity-free hybrid functional with a Gaussian-attenuating exact exchange in a plane-wave basis
2013 Song, Jong Won; Giorgi, Giacomo; Yamashita, Koichi; Hirao, Kimihiko
On the dual deuterium/deuteron nature of D charge distribution in the Ti host matrix: a DFT analysis
2013 Giorgi, Giacomo; Belanzoni, Paola; T., Asami; K., Yamashita
Unraveling the adsorption mechanism of aromatic and aliphatic diols on the TiO2 surface: A density functional theory analysis
2013 Giorgi, Giacomo; Fujisawa, Jun Ichi; Segawa, Hiroshi; Yamashita, Koichi
Small photocarrier effective masses featuring ambipolar transport in methylammonium lead iodide perovskite: A density functional analysis
2013 Giorgi, Giacomo; Fujisawa, Jun Ichi; Segawa, Hiroshi; Yamashita, Koichi
The first-principles study on the electronic and optical properties of (Ga1−xZnx)(N1−xOx) from many-body perturbation theory
2013 Kawai, Hiroki; Giorgi, Giacomo; Palummo, Maurizia; Yamashita, Koichi
Theoretical study on electronic properties of 2D graphene-TiO2 nanocomposites
2013 Masuda, Yasuyuki; Giorgi, Giacomo; Yamashita, Koichi
Bonding configurations and observed XPS features at the hydrogen terminated (100) Si surface: what can we gain from computational chemistry.
2013 Belanzoni, Paola; Giorgi, Giacomo; G. F., Cerofolini
Bridging the Fields of Solar Cell and Battery Research to Develop High-Performance Anodes for Photoelectrochemical Cells and Metal Ion Batteries
2013 Manzhos, Sergei; Giorgi, Giacomo
Graphdiyne Pores: “Ad Hoc” Openings for Helium Separation Applications
2014 Massimiliano, Bartolomei; Estela Carmona, Novillo; Marta I., Hernández; José Campos, Martínez; Pirani, Fernando; Giorgi, Giacomo
Penetration Barrier of Water through Graphynes Pores: First-Principles Predictions and Force Field Optimization
2014 Massimiliano, Bartolomei; Estela, Carmona Novillo; Marta, I. Hernandez; José, Campos Martinez; Pirani, Fernando; Giorgi, Giacomo; Koichi, Yamashita
Electronic and Optical Properties of Nitrogen-Doped Layered Manganese Oxides
2014 Giorgi, Giacomo; Yamashita, Koichi
Lead-iodide nanowire perovskite with methylviologen showing interfacial charge-transfer absorption: a DFT analysis
2014 Fujisawa, Jun ichi; Giorgi, Giacomo
Cation role in structural and electronic properties of 3D organic-inorganic halide perovskites: A DFT analysis
2014 Giorgi, Giacomo; Fujisawa, Jun Ichi; Segawa, Hiroshi; Yamashita, Koichi
First-principles study of fast Na diffusion in Na3P
2014 Yu, Xue Fang; Giorgi, Giacomo; Ushiyama, Hiroshi; Yamashita, Koichi
Legenda icone
- file ad accesso aperto
- file disponibili sulla rete interna
- file disponibili agli utenti autorizzati
- file disponibili solo agli amministratori
- file sotto embargo
- nessun file disponibile