activity
20062024
most citedOctopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems

415 citations · 1.6k across the 38 of their papers we have counts for

collaborators
Showing 2018Show all

5 papers · 1 filter

cond-mat.mes-hall2018★ 193 cited

Manipulating azobenzene photoisomerization through strong light-molecule coupling

Jacopo Fregoni, Giovanni Granucci, Emanuele Coccia +2

The formation of hybrid light-molecule states (polaritons) offers a new strategy to manipulate the photochemistry of molecules. To fully exploit its potential, one needs to build a…

cond-mat.mes-hall2018★ 12 cited

Shaping excitons in light-harvesting proteins through nanoplasmonics

Stefano Caprasecca, Stefano Corni, Benedetta Mennucci

Nanoplasmonics has been used to enhance molecular spectroscopic signals, with exquisite spatial resolution down to the sub-molecular scale. By means of a rigorous, state-of-the-art…

cond-mat.mtrl-sci2018★ 22 cited

Solid-State Effects on the Optical Excitation of Push-Pull Molecular J-Aggregates by First-Principles Simulations

Michele Guerrini, Arrigo Calzolari, Stefano Corni

J-aggregates are a class of low-dimensional molecular crystals which display enhanced interaction with light. These systems show interesting optical properties as an intense and na…

q-bio.BM2018★ 32 cited

Citrate stabilized gold nanoparticles interfere with amyloid fibril formation: D76N and ΔN6 \b{eta}2-microglobulin variants

Giorgia Brancolini, Maria Celeste Maschio, Cristina Cantarutti +5

Protein aggregation including the formation of dimers and multimers in solution, underlies an array of human diseases such as systemic amyloidosis which is a fatal disease caused b…

physics.chem-ph2018★ 34 cited

Probing quantum coherence in ultrafast molecular processes: an ab initio approach to open quantum systems

Emanuele Coccia, Filippo Troiani, Stefano Corni

Revealing possible long-living coherence in ultrafast processes allows detecting genuine quantum mechanical effects in molecules. To investigate such effects from a quantum chemist…