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The Journal of Chemical Physics
|
September 11, 2009
Linear and nonlinear susceptibilities from diffusion quantum Monte Carlo: application to periodic hydrogen chains
P Umari, Nicola Marzari
Physical Review Letters
|
October 9, 2002
Ab initio molecular dynamics in a finite homogeneous electric field
P Umari, Alfredo Pasquarello
Physical Review Letters
|
October 4, 2005
Fraction of boroxol rings in vitreous boron oxide from a first-principles analysis of Raman and NMR spectra
P Umari, Alfredo Pasquarello
The Journal of Chemical Physics
|
May 16, 2012
Importance of semicore states in GW calculations for simulating accurately the photoemission spectra of metal phthalocyanine molecules
P Umari, S Fabris
Physical Review Letters
|
February 7, 2003
Concentration of small ring structures in vitreous silica from a first-principles analysis of the Raman spectrum
P Umari, Xavier Gonze, Alfredo Pasquarello
The Journal of Chemical Physics
|
April 5, 2014
Approximate treatment of semicore states in GW calculations with application to Au clusters
Jiawei Xian, Stefano Baroni, P Umari
Physical Review Letters
|
October 4, 2005
Medium-range structural properties of vitreous germania obtained through first-principles analysis of vibrational spectra
Luigi Giacomazzi, P Umari, Alfredo Pasquarello
The Journal of Chemical Physics
|
May 16, 2012
Communication: electronic band gaps of semiconducting zig-zag carbon nanotubes from many-body perturbation theory calculations
P Umari, O Petrenko, S Taioli, et al.
Physical Review Letters
|
December 31, 2005
Dielectric response of periodic systems from quantum Monte Carlo calculations
P Umari, A J Willamson, Giulia Galli, et al.
The Journal of Chemical Physics
|
July 5, 2013
Energy-level alignment in organic dye-sensitized TiO2 from GW calculations
P Umari, L Giacomazzi, F De Angelis, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 15) with videos related to
Sort By:
Page
of 2
The Journal of Chemical Physics
|
September 11, 2009
Linear and nonlinear susceptibilities from diffusion quantum Monte Carlo: application to periodic hydrogen chains
P Umari, Nicola Marzari
Physical Review Letters
|
October 9, 2002
Ab initio molecular dynamics in a finite homogeneous electric field
P Umari, Alfredo Pasquarello
Physical Review Letters
|
October 4, 2005
Fraction of boroxol rings in vitreous boron oxide from a first-principles analysis of Raman and NMR spectra
P Umari, Alfredo Pasquarello
The Journal of Chemical Physics
|
May 16, 2012
Importance of semicore states in GW calculations for simulating accurately the photoemission spectra of metal phthalocyanine molecules
P Umari, S Fabris
Physical Review Letters
|
February 7, 2003
Concentration of small ring structures in vitreous silica from a first-principles analysis of the Raman spectrum
P Umari, Xavier Gonze, Alfredo Pasquarello
The Journal of Chemical Physics
|
April 5, 2014
Approximate treatment of semicore states in GW calculations with application to Au clusters
Jiawei Xian, Stefano Baroni, P Umari
Physical Review Letters
|
October 4, 2005
Medium-range structural properties of vitreous germania obtained through first-principles analysis of vibrational spectra
Luigi Giacomazzi, P Umari, Alfredo Pasquarello
The Journal of Chemical Physics
|
May 16, 2012
Communication: electronic band gaps of semiconducting zig-zag carbon nanotubes from many-body perturbation theory calculations
P Umari, O Petrenko, S Taioli, et al.
Physical Review Letters
|
December 31, 2005
Dielectric response of periodic systems from quantum Monte Carlo calculations
P Umari, A J Willamson, Giulia Galli, et al.
The Journal of Chemical Physics
|
July 5, 2013
Energy-level alignment in organic dye-sensitized TiO2 from GW calculations
P Umari, L Giacomazzi, F De Angelis, et al.
Page
of 2