papers
Publications (3)
cond-mat.mtrl-sci2010
Towards First-principles Electrochemistry
I. Dabo, E. Cancès, Y. L. Li +1
cond-mat.mtrl-sci2009
Non-Koopmans Corrections in Density-functional Theory: Self-interaction Revisited
I. Dabo, M. Cococcioni, N. Marzari
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