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Eleonora Luppi, Ph.D. - Publications

Affiliations: 
Chemistry Université Pierre et Marie Curie, Paris, Île-de-France, France 
Area:
Theoretical Chemistry
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41 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2019 Gauriot N, Véniard V, Luppi E. Long-range corrected exchange-correlation kernels to describe excitons in second-harmonic generation. The Journal of Chemical Physics. 151: 234111. PMID 31864278 DOI: 10.1063/1.5126501  0.623
2018 Labeye M, Zapata F, Coccia E, Veniard V, Toulouse J, Caillat J, Taïeb R, Luppi E. On the optimal basis set for electron dynamics in strong laser fields: The case of molecular ion H. Journal of Chemical Theory and Computation. PMID 30247900 DOI: 10.1021/Acs.Jctc.8B00656  0.612
2017 Coccia E, Assaraf R, Luppi E, Toulouse J. Ab initio lifetime correction to scattering states for time-dependent electronic-structure calculations with incomplete basis sets. The Journal of Chemical Physics. 147: 014106. PMID 28688444 DOI: 10.1063/1.4991563  0.381
2017 Bertocchi M, Degoli E, Véniard V, Luppi E, Ossicini S. Second Harmonic Generation in Silicon Based Heterostructures: The Role of Strain and Symmetry Nanoscience and Nanotechnology Letters. 9: 1102-1107. DOI: 10.1166/Nnl.2017.2445  0.715
2017 Degoli E, Luppi E, Capron N. Ab Initio Study of Electronic Transport in Cubic-HfO2 Grain Boundaries Journal of Nanomaterials. 2017: 1-9. DOI: 10.1155/2017/2404378  0.341
2016 Śmiga S, Franck O, Mussard B, Buksztel A, Grabowski I, Luppi E, Toulouse J. Self-consistent double-hybrid density-functional theory using the optimized-effective-potential method. The Journal of Chemical Physics. 145: 144102. PMID 27782500 DOI: 10.1063/1.4964319  0.338
2016 Sala VG, Dal Conte S, Miller TA, Viola D, Luppi E, Véniard V, Cerullo G, Wall S. Resonant optical control of the structural distortions that drive ultrafast demagnetization in Cr2 O3 Physical Review B - Condensed Matter and Materials Physics. 94. DOI: 10.1103/Physrevb.94.014430  0.645
2015 Franck O, Mussard B, Luppi E, Toulouse J. Basis convergence of range-separated density-functional theory. The Journal of Chemical Physics. 142: 074107. PMID 25702002 DOI: 10.1063/1.4907920  0.372
2015 Luppi E, Degoli E, Bertocchi M, Ossicini S, Véniard V. Strain-designed strategy to induce and enhance second-harmonic generation in centrosymmetric and noncentrosymmetric materials Physical Review B - Condensed Matter and Materials Physics. 92. DOI: 10.1103/Physrevb.92.075204  0.69
2015 White AF, Heide CJ, Saalfrank P, Head-Gordon M, Luppi E. Computation of high-harmonic generation spectra of the hydrogen molecule using time-dependent configuration-interaction Molecular Physics. 1-10. DOI: 10.1080/00268976.2015.1119900  0.476
2014 Bertocchi M, Luppi E, Degoli E, Véniard V, Ossicini S. Defects and strain enhancements of second-harmonic generation in Si/Ge superlattices. The Journal of Chemical Physics. 140: 214705. PMID 24908033 DOI: 10.1063/1.4880756  0.728
2013 Luppi E, Head-Gordon M. The role of Rydberg and continuum levels in computing high harmonic generation spectra of the hydrogen atom using time-dependent configuration interaction. The Journal of Chemical Physics. 139: 164121. PMID 24182018 DOI: 10.1063/1.4824482  0.529
2012 Cazzanelli M, Bianco F, Borga E, Pucker G, Ghulinyan M, Degoli E, Luppi E, Véniard V, Ossicini S, Modotto D, Wabnitz S, Pierobon R, Pavesi L. Second-harmonic generation in silicon waveguides strained by silicon nitride. Nature Materials. 11: 148-54. PMID 22138793 DOI: 10.1038/Nmat3200  0.742
2012 Cazzanelli M, Bianco F, Pavesi L, Ghulinyan M, Pucker G, Modotto D, Wabnitz S, Pigozzo FM, Ossicini S, Degoli E, Luppi E, Véniard V. Second-order nonlinear silicon photonics Spie Newsroom. 1-4. DOI: 10.1117/2.1201203.004138  0.748
2012 Bertocchi M, Luppi E, Degoli E, Véniard V, Ossicini S. Large crystal local-field effects in second-harmonic generation of a Si/CaF 2 interface: An ab initio study Physical Review B - Condensed Matter and Materials Physics. 86. DOI: 10.1103/Physrevb.86.035309  0.729
2012 Luppi E, Head-Gordon M. Computation of high-harmonic generation spectra of H 2 and N 2 in intense laser pulses using quantum chemistry methods and time-dependent density functional theory Molecular Physics. 110: 909-923. DOI: 10.1080/00268976.2012.675448  0.484
2011 Luppi E, Hübener H, Bertocchi M, Degoli E, Ossicini S, Véniard V. Second-harmonic generation spectroscopy from time-dependent density-functional theory Materials Research Society Symposium Proceedings. 1370: 29-34. DOI: 10.1557/Opl.2011.789  0.749
2011 Hübener H, Luppi E, Véniard V. Ab initio calculation of many-body effects on the second-harmonic generation spectra of hexagonal SiC polytypes Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.115205  0.692
2010 Luppi E, Hübener H, Véniard V. Communications: Ab initio second-order nonlinear optics in solids. The Journal of Chemical Physics. 132: 241104. PMID 20590173 DOI: 10.1063/1.3457671  0.696
2010 Luppi E, Hübener H, Véniard V. Ab initio second-order nonlinear optics in solids: Second-harmonic generation spectroscopy from time-dependent density-functional theory Physical Review B - Condensed Matter and Materials Physics. 82. DOI: 10.1103/Physrevb.82.235201  0.702
2010 Weissker HC, Serrano J, Huotari S, Luppi E, Cazzaniga M, Bruneval F, Sottile F, Monaco G, Olevano V, Reining L. Dynamic structure factor and dielectric function of silicon for finite momentum transfer: Inelastic x-ray scattering experiments and ab initio calculations Physical Review B - Condensed Matter and Materials Physics. 81. DOI: 10.1103/Physrevb.81.085104  0.657
2010 Hübener H, Luppi E, Véniard V. Ab initio calculation of second harmonic generation in solids Physica Status Solidi (B) Basic Research. 247: 1984-1991. DOI: 10.1002/Pssb.200983954  0.672
2008 Ossicini S, Bisi O, Degoli E, Marri I, Iori F, Luppi E, Magri R, Poli R, Cantele G, Ninno D, Trani F, Marsili M, Pulci O, Olevano V, Gatti M, et al. First-principles study of silicon nanocrystals: structural and electronic properties, absorption, emission, and doping. Journal of Nanoscience and Nanotechnology. 8: 479-92. PMID 18464361 DOI: 10.1166/Jnn.2008.A009  0.678
2008 Luppi E, Weissker HC, Bottaro S, Sottile F, Veniard V, Reining L, Onida G. Accuracy of the pseudopotential approximation in ab initio theoretical spectroscopies Physical Review B - Condensed Matter and Materials Physics. 78. DOI: 10.1103/Physrevb.78.245124  0.764
2007 Magri R, Degoli E, Iori F, Luppi E, Pulci O, Ossicini S, Cantele G, Trani F, Ninno D. Role of surface passivation and doping in silicon nanocrystals Journal of Computational Methods in Sciences and Engineering. 7: 219-232. DOI: 10.3233/Jcm-2007-73-404  0.65
2007 Luppi E, Iori F, Magri R, Pulci O, Ossicini S, Degoli E, Olevano V. Excitons in silicon nanocrystallites: The nature of luminescence Physical Review B - Condensed Matter and Materials Physics. 75. DOI: 10.1103/Physrevb.75.033303  0.62
2007 Palummo M, Bruno M, Pulci O, Luppi E, Degoli E, Ossicini S, Del Sole R. Ab-initio electronic and optical properties of low dimensional systems: From single particle to many-body approaches Surface Science. 601: 2696-2701. DOI: 10.1016/J.Susc.2006.12.019  0.722
2007 Iori F, Ossicini S, Degoli E, Luppi E, Poli R, Magri R, Cantele G, Trani F, Ninno D. Doping in silicon nanostructures Physica Status Solidi (a) Applications and Materials Science. 204: 1312-1317. DOI: 10.1002/Pssa.200674323  0.644
2006 Ossicini S, Iori F, Degoli E, Luppi E, Magri R, Poli R, Cantele G, Trani F, Ninno D. Understanding doping in silicon nanostructures Ieee Journal On Selected Topics in Quantum Electronics. 12: 1585-1590. DOI: 10.1109/Jstqe.2006.884087  0.645
2006 Iori F, Degoli E, Luppi E, Magri R, Marri I, Cantele G, Ninno D, Trani F, Ossicini S. Doping in silicon nanocrystals: An ab initio study of the structural, electronic and optical properties Journal of Luminescence. 121: 335-339. DOI: 10.1016/J.Jlumin.2006.08.062  0.64
2005 Ossicini S, Iori F, Degoli E, Luppi E, Magri R, Cantele G, Trani F, Ninno D. P and B single- and co-doped silicon nanocrystals: Formation and activation energies, electronic and optical properties 2005 Ieee International Conference On Group Iv Photonics. 2005: 60-62. DOI: 10.1109/GROUP4.2005.1516403  0.585
2005 Cantele G, Degoli E, Luppi E, Magri R, Ninno D, Iadonisi G, Ossicini S. First-principles study of n- and p-doped silicon nanoclusters Physical Review B - Condensed Matter and Materials Physics. 72. DOI: 10.1103/Physrevb.72.113303  0.626
2005 Ossicini S, Degoli E, Iori F, Luppi E, Magri R, Cantele G, Trani F, Ninno D. Simultaneously B- and P-doped silicon nanoclusters: Formation energies and electronic properties Applied Physics Letters. 87: 1-3. DOI: 10.1063/1.2119424  0.63
2005 Degoli E, Cantele G, Luppi E, Magri R, Ossicini S, Ninno D, Bisi O, Onida G, Gatti M, Incze A, Pulci O, Del Sole R. Ab-initio calculations of the electronic properties of silicon nanocrystals: Absorption, emission, stokes shift Aip Conference Proceedings. 772: 859-860. DOI: 10.1063/1.1994377  0.697
2005 Luppi E, Degoli E, Cantele G, Ossicini S, Magri R, Ninno D, Bisi O, Pulci O, Onida G, Gatti M, Incze A, Del Sole R. The electronic and optical properties of silicon nanoclusters: Absorption and emission Optical Materials. 27: 1008-1013. DOI: 10.1016/J.Optmat.2004.08.054  0.731
2005 Degoli E, Ossicini S, Cantele G, Luppi E, Magri R, Ninno D, Bisi O. Formation energies of silicon nanocrystals: Role of dimension and passivation Physica Status Solidi C: Conferences. 2: 3354-3358. DOI: 10.1002/Pssc.200561166  0.603
2005 Cantele G, Degoli E, Luppi E, Magri R, Ninno D, Bisi O, Ossicini S, Iadonisi G. Electronic, structural and optical properties of hydrogenated silicon nanocrystals: The role of the excited states Physica Status Solidi C: Conferences. 2: 3263-3267. DOI: 10.1002/Pssc.200461139  0.647
2005 Pulci O, Marsili M, Luppi E, Hogan C, Garbuio V, Sottile F, Magri R, Del Sole R. Electronic excitations in solids: Density functional and Green's function theory Physica Status Solidi (B) Basic Research. 242: 2737-2750. DOI: 10.1002/pssb.200541115  0.542
2004 Degoli E, Cantele G, Luppi E, Magri R, Ninno D, Bisi O, Ossicini S. Ab initio structural and electronic properties of hydrogenated silicon nanoclusters in the ground and excited state Physical Review B - Condensed Matter and Materials Physics. 69: 155411-1-155411-10. DOI: 10.1103/Physrevb.69.155411  0.663
2003 Ossicini S, Magri R, Degoli E, Luppi M, Luppi E. Surface and confinement effects on the optical and structural properties of silicon nanocrystals Proceedings of Spie - the International Society For Optical Engineering. 5222: 1-11. DOI: 10.1117/12.508481  0.551
2003 Degoli E, Ossicini S, Luppi M, Luppi E, Magri R, Cantele G, Ninno D. Electronic and Optical Properties of Silicon Nanocrystals: Structural Effects Materials Research Society Symposium - Proceedings. 770: 57-62.  0.592
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