Found 224 results
Filters: Type is Palaiseau Article  [Clear All Filters]
2013
, Role of localized electrons in electron-hole interaction: The case of SrTiO3, Phys. Rev. B, vol. 87. American Physical Society, p. 235102, 2013.
2012
, Approximations for many-body Green's functions: insights from the fundamental equations, New Journal of Physics, vol. 14. p. 013056, 2012.
, Beyond the GW approximation: Combining correlation channels, Phys. Rev. B, vol. 85. American Physical Society, p. 155131, 2012.
, Crystal structure of cold compressed graphite, Phys. Rev. Lett., vol. 108, 065501. 2012.
, Crystalline and magnetic anisotropy of the 3d-transition metal monoxides MnO, FeO, CoO, and NiO, Phys. Rev. B, vol. 86. American Physical Society, p. 115134, 2012.
, Efficient calculation of the polarizability: a simplified effective-energy technique, The European Physical Journal B, vol. 85. Springer-Verlag, pp. 1-10, 2012.
, Efficient GW calculations for SnO2, ZnO, and rubrene: The effective-energy technique, Phys. Rev. B, vol. 85. American Physical Society, p. 085126, 2012.
, The ETSF: An e-Infrastructure That Bridges Simulations and Experiments, Computing in Science & Engineering, vol. 14. 2012.
, Feedback mechanism for the stability of the band gap of CuInSe2, Phys. Rev. B, vol. 86, 045216. 2012.
, In memoriam of Professor Rodolfo Del Sole, physica status solidi (b), vol. 249. WILEY-VCH Verlag, pp. 1092–1094, 2012.
, Large crystal local-field effects in second-harmonic generation of a Si/CaF${}_{2}$ interface: An \textit{ab initio} study, Phys. Rev. B, vol. 86. American Physical Society, p. 035309, 2012.
, Low-energy excitations in strongly correlated materials: A theoretical and experimental study of the dynamic structure factor in V2O3, Phys. Rev. B, vol. 86. American Physical Society, p. 205132, 2012.
, Low-energy silicon allotropes with strong absorption in the visible for photovoltaic applications, Phys. Rev. B (Rapid Comm.), vol. 86, 121204. 2012.
, Novel Structural Motifs in Low Energy Phases of LiAlH4, Phys. Rev. Lett., vol. 108, 205505. 2012.
, p-doping in expanded phase of ZnO: An ab initio study, Phys. Rev. Lett., vol. 108, 115903. 2012.
, Plasmon satellites in valence-band photoemission spectroscopy, The European Physical Journal B, vol. 85. Springer-Verlag, pp. 1-7, 2012.
, Raman activity of sp3 carbon allotropes under pressure: A density functional theory study, Phys. Rev. B, vol. 85, 155428. 2012.
, Second-harmonic generation in silicon waveguides strained by silicon nitride, Nature Materials, vol. 11. p. 148, 2012.
, Speeding up the solution of the Bethe-Salpeter equation by a double-grid method and Wannier interpolation, Phys. Rev. B, vol. 86, 125203. 2012.
2011
, Ab initio calculation of many-body effects on the second-harmonic generation spectra of hexagonal SiC polytypes, Phys. Rev. B, vol. 83. American Physical Society, p. 115205, 2011.
, Band structures of Cu2ZnSnS4 and Cu2ZnSnSe4 from many-body methods, Appl. Phys. Lett., vol. 98, 241915. 2011.
, Density-based mixing parameter for hybrid functionals, Phys. Rev. B, vol. 83. American Physical Society, p. 035119, 2011.
M. Gatti, Design of effective kernels for spectroscopy and molecular transport: Time-dependent current–density-functional theory, The Journal of Chemical Physics, vol. 134. AIP, p. 084102, 2011.
, Double excitations in correlated systems: A many–body approach, J. Chem. Phys. , vol. 134, 034115. 2011.
, Dynamical response function in sodium and aluminum from time-dependent density-functional theory, Phys. Rev. B, vol. 84. American Physical Society, p. 075109, 2011.