Pubblicazioni

A database of high-pressure crystal structures from hydrogen to lanthanum

2024 - SCIENTIFIC DATA
Giannessi, Federico; Di Cataldo, Simone; Saha, Santanu; Boeri, Lilia

In-depth exploration of catalytic sites on amorphous solid water: I. The astrosynthesis of aminomethanol

2024 - PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Bovolenta, Giulia M.; Silva-Vera, Gabriela; Bovino, Stefano; Molpeceres, German; Kästner, Johannes; Vogt-Geisse, Stefan

Breakdown of optical phonons' splitting in two-dimensional materials

2017 - NANO LETTERS
Sohier, Thibault; Gibertini, Marco; Calandra, Matteo; Mauri, Francesco; Marzari, Nicola

Density functional perturbation theory for gated two-dimensional heterostructures: theoretical developments and application to flexural phonons in graphene

2017 - PHYSICAL REVIEW. B
Sohier, Thibault; Calandra, Matteo; Mauri, Francesco

Enamine/dienamine and brønsted acid catalysis: elusive intermediates, reaction mechanisms, and stereoinduction modes based on in situ NMR spectroscopy and computational studies

2017 - ACCOUNTS OF CHEMICAL RESEARCH
Renzi, Polyssena; Hioe, Johnny; Gschwind, Ruth M.

Micro- and mesoscopic structural features of a bio-based choline-amino acid ionic liquid

2016 - RSC ADVANCES
Russina, Olga; DE SANTIS, Serena; Gontrani, Lorenzo

© Università degli Studi di Roma "La Sapienza" - Piazzale Aldo Moro 5, 00185 Roma