Pubblicazioni

Theoretical study of ionic liquids based on the cholinium cation. Ab initio simulations of their condensed phases

2016 - THE JOURNAL OF CHEMICAL PHYSICS

Campetella, Marco; Bodo, Enrico; Montagna, Maria; De Santis, Serena; Gontrani, Lorenzo

NEXAFS spectroscopy and site-specific fragmentation of N -methylformamide, N,N -dimethylformamide, and N,N -dimethylacetamide

2016 - THE JOURNAL OF CHEMICAL PHYSICS

SalÃ©n, Peter; Yatsyna, Vasyl; Schio, Luca; Feifel, Raimund; Richter, Robert; Alagia, Michele; Stranges, Stefano; Zhaunerchyk, Vitali

Angular and energy distributions of fragment ions in dissociative double photoionization of acetylene molecules in the 31.9-50.0 eV photon energy range

2016 - THE JOURNAL OF CHEMICAL PHYSICS

Falcinelli, Stefano; Alagia, Michele; Farrar, James M.; Kalogerakis, Konstantinos S.; Pirani, Fernando; Richter, Robert; Schio, Luca; Stranges, Stefano; Rosi, Marzio; Vecchiocattivi, Franco

Electronic excitations in solution-processed oligothiophene small-molecules for organic solar cells

2016 - THE JOURNAL OF CHEMICAL PHYSICS

Gala, Fabrizio; Mattiello, Leonardo; Brunetti, Francesca; Zollo, Giuseppe

Focus Article: Theoretical aspects of vapor/gas nucleation at structured surfaces

2016 - THE JOURNAL OF CHEMICAL PHYSICS

Meloni, Simone; Giacomello, Alberto; Casciola, Carlo Massimo

On the properties of a bundle of flexible actin filaments in an optical trap

2016 - THE JOURNAL OF CHEMICAL PHYSICS

Perilli, Alessia; Pierleoni, Carlo; Ciccotti, Giovanni; Ryckaert, JEAN PAUL

Structural and vibrational study of 2-MethoxyEthylAmmonium nitrate (2-OMeEAN): interpretation of experimental results with ab initio molecular dynamics

2016 - THE JOURNAL OF CHEMICAL PHYSICS

Campetella, M.; Bovi, D.; Caminiti, R.; Guidoni, L.; Bencivenni, L.; Gontrani, L.

Small-angle neutron scattering and molecular dynamics structural study of gelling DNA nanostars

2016 - THE JOURNAL OF CHEMICAL PHYSICS

FERNANDEZ CASTANON, Javier; Bomboi, Francesca; Rovigatti, Lorenzo; Zanatta, Marco; Paciaroni, Alessandro; Comez, Lucia; Porcar, Lionel; Jafta, Charl J.; Fadda, Giulia C.; Bellini, Tomasso; Sciortino, Francesco

Potential energy landscape of the apparent first-order phase transition between low-density and high-density amorphous ice

2016 - THE JOURNAL OF CHEMICAL PHYSICS

Giovambattista, Nicolas; Sciortino, Francesco; Starr, Francis W.; Poole, Peter H.

Ricerc@Sapienza

Pubblicazioni

Theoretical study of ionic liquids based on the cholinium cation. Ab initio simulations of their condensed phases

NEXAFS spectroscopy and site-specific fragmentation of N -methylformamide, N,N -dimethylformamide, and N,N -dimethylacetamide

Angular and energy distributions of fragment ions in dissociative double photoionization of acetylene molecules in the 31.9-50.0 eV photon energy range

Electronic excitations in solution-processed oligothiophene small-molecules for organic solar cells

Focus Article: Theoretical aspects of vapor/gas nucleation at structured surfaces

On the properties of a bundle of flexible actin filaments in an optical trap

Structural and vibrational study of 2-MethoxyEthylAmmonium nitrate (2-OMeEAN): interpretation of experimental results with ab initio molecular dynamics

Small-angle neutron scattering and molecular dynamics structural study of gelling DNA nanostars

Potential energy landscape of the apparent first-order phase transition between low-density and high-density amorphous ice

Crystals of Janus colloids at various interaction ranges

Two structural relaxations in protein hydration water and their dynamic crossovers

Crystal nucleation as the ordering of multiple order parameters