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#TitleJournalYearCitations
1Advanced capabilities for materials modelling with Quantum ESPRESSOJournal of Physics Condensed Matter20174,303
2ABINIT: First-principles approach to material and nanosystem propertiesComputer Physics Communications20092,297
3Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systemsJournal of Chemical Physics2020210
4Universal infrared absorbance of two-dimensional honeycomb group-IV crystalsPhysical Review B2013157
5Infrared absorbance of silicene and germaneneApplied Physics Letters2012144
6Origin of Dirac-cone-like features in silicon structures on Ag(111) and Ag(110)Journal of Applied Physics201368
7Comment on “Huge Excitonic Effects in Layered Hexagonal Boron Nitride”Physical Review Letters200864
8Role of Cellulose Oxidation in the Yellowing of Ancient PaperPhysical Review Letters201264
9Performance of genetic algorithms in search for water splitting perovskitesJournal of Materials Science201342
10Optical response of strongly absorbing inhomogeneous materials: Application to paper degradationPhysical Review B201440
11Side-dependent electron escape from graphene- and graphane-like SiC layersApplied Physics Letters201239
12Azimuthal Dichroism in Near-Edge X-ray Absorption Fine Structure Spectra of Planar MoleculesJournal of Physical Chemistry C201332
13Terahertz Absorption by Cellulose: Application to Ancient Paper ArtifactsPhysical Review Applied201732
14Visual degradation in Leonardo da Vinci's iconic self-portrait: A nanoscale studyApplied Physics Letters201431
15High resolution NEXAFS of perylene and PTCDI: a surface science approach to molecular orbital analysisPhysical Chemistry Chemical Physics201428
16Ground state structures and electronic excitations of biological chromophores at Quantum Monte Carlo/Many Body Green’s Function Theory levelComputational and Theoretical Chemistry201426
17Excitons in two-dimensional sheets with honeycomb symmetryPhysica Status Solidi (B): Basic Research201523
18Enhanced Atom Mobility on the Surface of a Metastable FilmPhysical Review Letters201422
19Conductance of a photochromic molecular switch with graphene leadsPhysical Review B201121
20Anchoring and Bending of Pentacene on Aluminum (001)Journal of Physical Chemistry C201521
21Crucial electronic contributions to measures of surface diffusion by He atom scatteringPhysical Review B200820
22Surface dynamics and friction of K/Cu(001) characterized by helium-3 spin-echo and density functional theoryPhysical Review B200920
23TiO2(110) Charge Donation to an Extended π-Conjugated MoleculeJournal of Physical Chemistry Letters201520
24Graphene magnetism induced by covalent adsorption of aromatic radicalsPhysical Chemistry Chemical Physics201520
25An ab-initio approach to cultural heritage: The case of ancient paper degradationPhysica Status Solidi (B): Basic Research201517
26Test of long-range exchange-correlation kernels of time-dependent density functional theory at surfaces: Application toSi(111)2×1Physical Review B201016
27Optical properties of flavin mononucleotide: A QM/MM study of protein environment effectsChemical Physics201116
28Finite homogeneous electric fields in the projector augmented wave formalism: Applications to linear and nonlinear responseComputational Materials Science201216
29Geometric, electronic, and optical properties of the Si(111)2×1 surface: Positive and negative bucklingPhysical Review B201215
30Experimental and Theoretical Study of the Yellowing of Ancient PaperE-Journal of Surface Science and Nanotechnology201215
31Ab initiocalculation of core-valence-valence Auger spectra in closed shell systemsPhysical Review B200814
32Many-body study of the photoisomerization of the minimal model of the retinal protonated Schiff baseChemical Physics Letters201113
33Spin-Dependent On-Site Electron Correlations and Localization in Itinerant FerromagnetsPhysical Review Letters201212
34Resonant Lifetime of Core-Excited Organic Adsorbates from First PrinciplesJournal of Physical Chemistry C201412
35Anomalous Aharonov–Bohm Gap Oscillations in Carbon NanotubesNano Letters20119
36Core-level spectra and molecular deformation in adsorption: V-shaped pentacene on Al(001)Beilstein Journal of Nanotechnology20159
37Quantitative diagnostics of ancient paper using THz time-domain spectroscopyMicrochemical Journal20189
38Non-destructive monitoring of molecular modifications in the restoration of works of art on paper⋆European Physical Journal Plus20198
39Oxygen Defect Stability in Amorphous, C-Axis Aligned, and Spinel IGZOACS Applied Electronic Materials20218
40First-principles calculations and bias-dependent STM measurements at the α-Sn/Ge(111) surfaceEurophysics Letters20097
41Theoretical optical spectroscopy of complex systemsJournal of Electron Spectroscopy and Related Phenomena20137
42Proton disorder in cubic ice: Effect on the electronic and optical propertiesJournal of Chemical Physics20157
43Detailed features of the surface electronic states of K/Cu(111) by density functional theoryPhysical Review B20106
44Conductance calculation of hydrogen molecular junctions between Cu electrodesPhysical Review B20136
45Si(111)2×1 surface isomers: DFT investigations on stability and doping effectsSurface Science20146
46Electronic structure and magnetism of strained bcc phases across the fcc to bcc transition in ultrathin Fe filmsPhysical Review B20166
47Charge redistribution in the formation of one-dimensional lithium wires on Cu(001)Physical Review B20105
48Many body effects in the electronic and optical properties of the (111) surface of diamondSurface Science20074
49Short-range lateral interactions and depolarization of Na atoms on Cu surfacesJournal of Physics Condensed Matter20104
50Electronic and magnetic properties of bulk Cr tips for scanning tunneling spectroscopyPhysical Review B20134