papers
Publications (5)
cond-mat.mtrl-sci2017
Advanced capabilities for materials modelling with Quantum ESPRESSO
P. Giannozzi, O. Andreussi, T. Brumme +47
cond-mat.mtrl-sci2007
DC Conductance of Molecular Wires
E. Prodan, R. Car
cond-mat.mtrl-sci1998
First principles study of adsorbed Cu_n (n=1-4) microclusters on MgO(100): structural and electronic properties
V. Musolino, A. Selloni, R. Car
cond-mat.mtrl-sci2003
First-principle molecular dynamics with ultrasoft pseudopotentials: parallel implementation and application to extended bio-inorganic system
P. Giannozzi, F. De Angelis, R. Car
cond-mat.mtrl-sci2009
Quantum ESPRESSO: a modular and open-source software project for quantum simulations of materials
P. Giannozzi, S. Baroni, N. Bonini +30