Publications 


[2017] [2016] [2015] [2014] [2013] [2012] [2011] [2010] [2009] [2008] [2007] [2006] [2005]

  2008

  =============================================================

1) Charge Transport in Disordered Graphene-Based Low Dimensional Materials
A. Cresti, N. Nemec, B. Biel, G. Niebler, F. Triozon, G. Cuniberti, S. Roche,
NANO RESEARCH 1, 361-394 (2008).

2) Tight-binding versus effective mass approximation calculation of electronic structures of semiconductor nanocrystals and nanowires
NH. Quang, NT. Truc, YM. Niquet,
COMPUTATIONAL MATERIALS SCIENCE 44, 21-25 (2008).

3) Quasiparticle Chirality in Epitaxial Graphene Probed at the Nanometer Scale
I. Brihuega, P. Mallet, C. Bena, S. Bose, C. Michaelis, L. Vitali, F. Varchon, L. Magaud, K. Kern, JY. Veuillen,
PHYSICAL REVIEW LETTERS 101, 206802 (2008).

4) Ab Initio GW Many-Body Effects in Graphene
PE. Trevisanutto, C. Giorgetti, L. Reining, M. Ladisa, V. Olevano,
PHYSICAL REVIEW LETTERS 101, 226405 (2008).

5) Magnetism without magnetic impurities in oxides ZrO2 and TiO2
F. Maca, J. Kudrnovsky, V. Drchal, G. Bouzerar,
PHILOSOPHICAL MAGAZINE 88, 2755-2764 (2008).

6) The Effect of Electron Doping on the Physical Properties of La1-xCexMnO3 Manganites
S. Othmani, M. Bejar, A. Tozri, E. Dhari, EK. Hlil,
FERROELECTRICS 371, 119-126 (2008).

7) Ab initio study of electron-phonon coupling in boron-doped SiC
ER. Margine, X. Blase,
APPLIED PHYSICS LETTERS 93, 192510 (2008).

8) Specification of an extensible and portable file format for electronic structure and crystallographic data
X. Gonze, CO. Almbladh, A. Cucca, D. Caliste, C. Freysoldt, MAL. Marques, V. Olevano, Y. Pouillon, MJ. Verstraete,
COMPUTATIONAL MATERIALS SCIENCE 43, 1056-1065 (2008).

9) Graphene-substrate interaction on 6H-SiC(000(1)over bar): A scanning tunneling microscopy study
F. Hiebel, P. Mallet, F. Varchon, L. Magaud, JY. Veuillen,
PHYSICAL REVIEW B 78, 153412 (2008).

10) A self-consistent calculation of band structure in silicon nanowires using a Tight-Binding model
E. Sarrazin, S. Barraud, F. Triozon, A. Bournel,
SISPAD: 2008 INTERNATIONAL CONFERENCE ON SIMULATION OF SEMICONDUCTOR , 349-352 (2008).

11) Sharing electronic structure and crystallographic data with ETSF_IO
D. Caliste, Y. Pouillon, MJ. Verstraete, V. Olevano, X. Gonze,
COMPUTER PHYSICS COMMUNICATIONS 179, 748-758 (2008).

12) Magnetocaloric properties of Fe2-xTxP (T = Ru and Rh) from electronic structure calculations and magnetization measurements
B. Wiendlocha, J. Tobola, S. Kaprzyk, R. Zach, EK. Hlil, D. Fruchart,
JOURNAL OF PHYSICS D-APPLIED PHYSICS 41, 205007 (2008).

13) Electronic transport in AlMn(Si) and AlCuFe quasicrystals: Breakdown of the semiclassical model
GT. de Laissardiere, JP. Julien, D. Mayou,
PHILOSOPHICAL MAGAZINE 88, 2131-2144 (2008).

14) Discussion of electronic properties of quasicrystals
D. Mayou,
PHILOSOPHICAL MAGAZINE 88, 2209-2215 (2008).

15) Thermal Stability of Graphene and Nanotube Covalent Functionalization
ER. Margine, ML. Bocquet, X. Blase,
NANO LETTERS 8, 3315-3319 (2008).

16) Dynamic aspects of the liquid-liquid phase transformation in silicon
N. Jakse, A. Pasturel,
JOURNAL OF CHEMICAL PHYSICS 129, 104503 (2008).

17) Mixed time-dependent density-functional theory/classical trajectory surface hopping study of oxirane photochemistry
E. Tapavicza, I. Tavernelli, U. Rothlisberger, C. Filippi, ME. Casida,
JOURNAL OF CHEMICAL PHYSICS 129, 124108 (2008).

18) Glass forming ability and short-range order in a binary bulk metallic glass by ab initio molecular dynamics
N. Jakse, A. Pasturel,
APPLIED PHYSICS LETTERS 93, 113104 (2008).

19) Doping-induced anisotropic lattice strain in homoepitaxial heavily boron-doped diamond
T. Wojewoda, P. Achatz, L. Ortega, F. Omnes, C. Marcenat, E. Bourgeois, X. Blase, F. Jomard, E. Bustarret,
DIAMOND AND RELATED MATERIALS 17, 1302-1306 (2008).

20) Magnetic and electronic Co states in the layered cobaltate GdBaCo2O5.5-x
M. Garcia-Fernandez, V. Scaunoli, U. Staub, AM. Mulders, M. Janousch, Y. Bodenthin, D. Meister, BD. Patterson, A. Mirone, Y. Tanaka, T. Nakamura, S. Grenier, Y. Huang, K. Conder,
PHYSICAL REVIEW B 78, 054424 (2008).

21) Quenching of the quantum Hall effect in multilayered epitaxial graphene: The role of undoped planes
P. Darancet, N. Wipf, C. Berger, WA. de Heer, D. Mayou,
PHYSICAL REVIEW LETTERS 101, 116806 (2008).

22) Resolving antiferromagnetic states in magnetically coupled amorphous Co-Si-Si multilayers by soft x-ray resonant magnetic scattering
SM. Valvidares, C. Quiros, A. Mirone, JM. Tonnerre, S. Stanescu, P. Bencok, Y. Souche, L. Zarate, JI. Martin, M. Velez, NB. Brookes, JM. Alameda,
PHYSICAL REVIEW B 78, 064406 (2008).

23) Ab initio calculation of Zn0.8Mn0.2O1-yNy
O. Mounkachi, A. Benyoussef, A. El Kenz, EH. Saidi, EK. Hlil,
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS 320, 2760-2765 (2008).

24) Charge transport in chemically doped 2D graphene
A. Lherbier, X. Blase, YM. Niquet, F. Triozon, S. Roche,
PHYSICAL REVIEW LETTERS 101, 036808 (2008).

25) High-field orientational magnetic phase diagrams of the mixed holmium-yttrium iron garnet Ho0.43Y2.57Fe5O12
A. Bouguerra, G. Fillion, S. de Brion, S. Khene, P. Wolfers, EK. Hlil,
JOURNAL OF PHYSICS-CONDENSED MATTER 20, 295231 (2008).

26) Trial wave functions for high-pressure metallic hydrogen
C. Pierleoni, KT. Delaney, MA. Morales, DM. Ceperley, M. Holzmann,
COMPUTER PHYSICS COMMUNICATIONS 179, 89-97 (2008).

27) Multiscale method for Heisenberg spin simulations
T. Jourdan, A. Marty, F. Lancon,
PHYSICAL REVIEW B 77, 224428 (2008).

28) Ripples in epitaxial graphene on the Si-terminated SiC(0001) surface
F. Varchon, P. Mallet, JY. Veuillen, L. Magaud,
PHYSICAL REVIEW B 77, 235412 (2008).

29) Daubechies wavelets as a basis set for density functional pseudopotential calculations
L. Genovese, A. Neelov, S. Goedecker, T. Deutsch, SA. Ghasemi, A. Willand, D. Caliste, O. Zilberberg, M. Rayson, A. Bergman, R. Schneider,
JOURNAL OF CHEMICAL PHYSICS 129, 014109 (2008).

30) Electric transport properties of RNi3Sn2 compounds (R = Y, Sm, Gd, Tb, Dy) and electronic structure of YNi3Sn2 and GdNi3Sn2
VV. Romaka, B. Kuzhel, EK. Hlil, L. Romaka, D. Fruchart, D. Gignoux,
JOURNAL OF ALLOYS AND COMPOUNDS 459, 8-12 (2008).

31) Atomic structure of Mn-rich nanocolumns probed by x-ray absorption spectroscopy
M. Rovezzi, T. Devillers, E. Arras, F. d'Acapito, A. Barski, M. Jamet, P. Pochet,
APPLIED PHYSICS LETTERS 92, 242510 (2008).

32) Study of Ba and Zr stability in UO2 +/- x by density functional calculations
G. Brillant, A. Pasturel,
PHYSICAL REVIEW B 77, 184110 (2008).

33) Zone-center instability of C(5,0) carbon nanotubes inside AIPO(4)-5 channels
MV. Fernandez-Serra, X. Blase,
PHYSICAL REVIEW B 77, 195115 (2008).

34) Influence of hydrogenation on structure and magnetic properties of HoFe11-xCoxTi
N. Tajabor, MR. Alinejad, L. Motevalizadeh, D. Fruchart, EK. Hlil, D. Gignoux, S. Miraglia,
JOURNAL OF ALLOYS AND COMPOUNDS 458, 91-95 (2008).

35) Comment on "Large-scale Monte Carlo study of a realistic lattice model for Ga1-xMnxAs"
G. Bouzerar, R. Bouzerar,
PHYSICAL REVIEW LETTERS 100, 229701 (2008).

36) Ab initio approaches to designing thermodynamic properties of materials
A. Pasturel, N. Jakse,
MATERIALS ISSUES FOR GENERATION IV SYSTEMS: STATUS, OPEN QUESTIONS AND , 141-152 (2008).

37) Magnetism without magnetic impurities in ZrO2 oxide
F. Maca, J. Kudrnovsky, V. Drchal, G. Bouzerar,
APPLIED PHYSICS LETTERS 92, 212503 (2008).

38) Kosterlitz-Thouless transition of the quasi-two-dimensional trapped Bose gas
M. Holzmann, W. Krauth,
PHYSICAL REVIEW LETTERS 100, 190402 (2008).

39) Linear plasmon dispersion in single-wall carbon nanotubes and the collective excitation spectrum of graphene
C. Kramberger, R. Hambach, C. Giorgetti, MH. Rummeli, M. Knupfer, J. Fink, B. Buchner, L. Reining, E. Einarsson, S. Maruyama, F. Sottile, K. Hannewald, V. Olevano, AG. Marinopoulos, T. Pichler,
PHYSICAL REVIEW LETTERS 100, 196803 (2008).

40) Lattice dynamics of skutterudites: Inelastic x-ray scattering on CoSb3
M. Rotter, P. Rogl, A. Grytsiv, W. Wolf, M. Krisch, A. Mirone,
PHYSICAL REVIEW B 77, 144301 (2008).

41) Scanning tunneling spectroscopy of cleaved InAs/GaAs quantum dots at low temperatures
A. Urbieta, B. Grandidier, JP. Nys, D. Deresmes, D. Stievenard, A. Lemaitre, G. Patriarche, YM. Niquet,
PHYSICAL REVIEW B 77, 155313 (2008).

42) Rotational disorder in few-layer graphene films on 6H-SiC(000-1): A scanning tunneling microscopy study
F. Varchon, P. Mallet, L. Magaud, JY. Veuillen,
PHYSICAL REVIEW B 77, 165415 (2008).

43) Semiclassical theory of the quasi-two-dimensional trapped Bose gas
M. Holzmann, M. Chevallier, W. Krauth,
EPL 82, 30001 (2008).

44) Screening and polaronic effects induced by a metallic gate and a surrounding oxide on donor and acceptor impurities in silicon nanowires
M. Diarra, C. Delerue, YM. Niquet, G. Allan,
JOURNAL OF APPLIED PHYSICS 103, 073703 (2008).

45) Stress enhanced self-diffusion in Si: Entropy effect in anisotropic elastic environment
KZ. Rushchanskii, P. Pochet, F. Lancon,
APPLIED PHYSICS LETTERS 92, 152110 (2008).

46) Why multilayer graphene on 4H-SiC(000(1)over-bar) behaves like a single sheet of graphene
J. Hass, F. Varchon, JE. Millan-Otoya, M. Sprinkle, N. Sharma, WA. De Heer, C. Berger, PN. First, L. Magaud, EH. Conrad,
PHYSICAL REVIEW LETTERS 100, 125504 (2008).

47) Orbital hybridization and spin polarization in the resonant 1s photoexcitations of alpha-Fe2O3
P. Glatzel, A. Mirone, SG. Eeckhout, M. Sikora, G. Giuli,
PHYSICAL REVIEW B 77, 115133 (2008).

48) Quantum dots and tunnel barriers in InAsOInP nanowire heterostructures: Electronic and optical properties
YM. Niquet, DC. Mojica,
PHYSICAL REVIEW B 77, 115316 (2008).

49) Clay-clast aggregates: A new textural evidence for seismic fault sliding?
S. Boutareaud, DG. Calugaru, R. Han, O. Fabbri, K. Mizoguchi, A. Tsutsumi, T. Shimamoto,
GEOPHYSICAL RESEARCH LETTERS 35, L05302 (2008).

50) Quantum transport length scales in silicon-based semiconducting nanowires: Surface roughness effects
A. Lherbier, MP. Persson, YM. Niquet, F. Triozon, S. Roche,
PHYSICAL REVIEW B 77, 085301 (2008).

51) Preserved conductance in covalently functionalized silicon nanowires
X. Blase, MV. Fernandez-Serra,
PHYSICAL REVIEW LETTERS 100, 046802 (2008).

52) Stability of plutonium compounds Pu1-xMx (M = Al, Ga, In, Zn and Ge)
B. Siberchicot, G. Robert, A. Pasturel,
JOURNAL OF ALLOYS AND COMPOUNDS 451, 691-693 (2008).

53) Transport length scales in disordered graphene-based materials: Strong localization regimes and dimensionality effects
A. Lherbier, B. Biel, YM. Niquet, S. Roche,
PHYSICAL REVIEW LETTERS 100, 036803 (2008).

54) Profile of the U 5f magnetization in U/Fe multilayers
SD. Brown, L. Bouchenoire, P. Thompson, R. Springell, A. Mirone, WG. Stirling, A. Beesley, MF. Thomas, RCC. Ward, MR. Wells, S. Langridge, SW. Zochowski, GH. Lander,
PHYSICAL REVIEW B 77, 014427 (2008).

55) Low-dimensional quantum transport properties of chemically-disordered carbon nanotubes: From weak to strong localization regimes
R. Avriller, S. Roche, F. Triozon, X. Blase, S. Latil,
MODERN PHYSICS LETTERS B 21, 1955-1982 (2007).

56) Understanding correlations in vanadium dioxide from first principles
M. Gatti, F. Bruneval, V. Olevano, L. Reining,
PHYSICAL REVIEW LETTERS 99, 266402 (2007).

57) Efficient ab initio calculations of bound and continuum excitons in the absorption spectra of semiconductors and insulators
F. Sottile, M. Marsili, V. Olevano, L. Reining,
PHYSICAL REVIEW B 76, 161103 (2007).

58) Superexchange induced canted ferromagnetism in dilute magnets
G. Bouzerar, R. Bouzerar, O. Cepas,
PHYSICAL REVIEW B 76, 144419 (2007).