Frédéric Lançon - Academia.edu (original) (raw)
Papers by Frédéric Lançon
Journal de Physique I, 1994
... On choosing a proper basis for deternùning structures of quasicrystals Frédéric Lançon (),Luc... more ... On choosing a proper basis for deternùning structures of quasicrystals Frédéric Lançon (),Luc Billard (), Sergei Burkov (>*) and Marc de Boissieu () ( Département de Recherche Fondamentale sur la Matière Condensée, CEA, SP2M /MP, 38054 ...
Physical review. B, Condensed matter, Jan 15, 1988
The present extended x-ray-absorption fine-structure (EXAFS) investigation aims at determining th... more The present extended x-ray-absorption fine-structure (EXAFS) investigation aims at determining the atom-pair displacements on a local scale in the Au1-xNix system, for the three types of pairs Au-Au, Au-Ni, and Ni-Ni. X-ray-absorption spectra have been obtained above both edges (Au L3 and Ni K), over the whole composition range. For the purpose of the separation of the Au and Ni
EMC 2008 14th European Microscopy Congress 1–5 September 2008, Aachen, Germany, 2008
ABSTRACT A non-symmetric and non-periodic (001)/(110) Si grain boundary (GB) has been experimenta... more ABSTRACT A non-symmetric and non-periodic (001)/(110) Si grain boundary (GB) has been experimental studied by transmission electron microscopy (TEM) and its atomic structure refined by atomic simulation. The (001)/(110) Si grain boundary was made by bonding together two different 4” Si wafers, having respectively (001) and (110) surfaces. The wafers were carefully aligned in order that they have a common in-plane [110] direction. In the interface perpendicular to [110], the [110] direction of the first grain is then parallel to the [001] direction of the second grain (figure 2). As the ratio of the norms of these two directions is equal to Ö2 \sqrt 2 , it is mathematically impossible to have a common period along these directions and the GB is said to be incommensurate [1].
Journal de Physique I, 1997
Physical Review E, 1999
... ERWAN ADAM, LUC BILLARD, AND FRÉDÉRIC LANC¸ON ... This number corre-sponds to the number of c... more ... ERWAN ADAM, LUC BILLARD, AND FRÉDÉRIC LANC¸ON ... This number corre-sponds to the number of configurations j really connected to i. For each of the following four algorithms, we have car-ried out five numerical simulations corresponding to five different random ...
Physical Review B, 2008
A multiscale method that couples classical Heisenberg model to micromagnetics in a unified formal... more A multiscale method that couples classical Heisenberg model to micromagnetics in a unified formalism is presented. It is based on a multiresolution adaptive finite difference mesh, which ensures significant reduction of the number of variables and computation time with respect to either atomistic or micromagnetic simulations, together with a precise description of the modeled system where necessary. The hierarchical structure
Physical Review B - Condensed Matter and Materials Physics, 2010
We report on the structural properties of Ge1−xM nx layers grown by molecular beam epitaxy. In th... more We report on the structural properties of Ge1−xM nx layers grown by molecular beam epitaxy. In these layers, nanocolumns with a high Mn content are embedded in an almost-pure Ge matrix. We have used grazing-incidence X-ray scattering, atomic force and transmission electron microscopy to study the structural properties of the columns. We demonstrate how the elastic deformation of the matrix (as calculated using atomistic simulations) around the columns, as well as the average inter-column distance can account for the shape of the diffusion around Bragg peaks.
Thin Solid Films, 2010
We compare here the different oxidization protocols that can be used to generate an SiO2/Si inter... more We compare here the different oxidization protocols that can be used to generate an SiO2/Si interface. All these protocols are based on molecular dynamics at high temperature but differ by the way the oxygen atoms are incorporated one-by-one. When they are inserted between two neighbouring Si atoms, forming one of the Si–Si pair closest to the surface, the silicon oxide
Surface Science, 2002
Grazing-incidence X-ray diffraction data are combined with energy-minimization calculations to an... more Grazing-incidence X-ray diffraction data are combined with energy-minimization calculations to analyse the atomic structure of the Al-rich (3 ffiffi ffi 3 p  3 ffiffi ffi 3 p )R30°reconstructed surface of sapphire a-Al 2 O 3 ð0 0 0 1Þ. The experiments on the BM32 beamline of the ESRF provide the non-integer-order diffraction intensities and, after Fourier transform, an incomplete Patterson map. The computer simulations are implemented to obtain structural information from this map. In the simulations, the interactions between the Al overlayer atoms were described with the Sutton-Chen potential and the interactions between the overlayer and the sapphire substrate with a laterally modulated Lennard-Jones potential. We have shown that the hexagonal reconstructed unit cell is composed of triangles where the two layers of Al adatoms are FCC(1 1 1) ordered whereas between the triangles the stacking is FCC(0 0 1). Ó
Physical Review Letters, 1990
The equations of the smoothening dynamics of a crystal surface below the roughening transition ar... more The equations of the smoothening dynamics of a crystal surface below the roughening transition are written in the case of evaporation dynamics. It is assumed that only ledges separating smooth planes are mobile. The equations are applied to the classical experiment in which the decay of parallel grooves is studied. The formation of facets, which has been observed, is argued
Physical Review Letters, 2003
An in-plane perpendicular magnetic coupling between Ni 80 Fe 20 and Co has been found in NiFe=NiO... more An in-plane perpendicular magnetic coupling between Ni 80 Fe 20 and Co has been found in NiFe=NiO=Co trilayers for a NiO thickness ranging from 4 to 25 nm by magneto-optical Kerr effect and x-ray magnetic circular dichroism measurements. In the easy magnetization direction of the Co layer, the Co coercive field H C increases when the thickness of the NiO layer t NiO increases. Because of the coupling, H C is always larger than for NiO=Co bilayers with the same thicknesses. The saturation field of the NiFe layer H S decreases when t NiO increases, indicating a weakening of the coupling. Numerical simulations show that the presence of interface roughness combined with a small value of the NiO anisotropy can explain the observed 90 coupling.
Physical Review B, 2007
... REVIEW B 75, 125203 2007 Germanium diffusion mechanisms in silicon from first principles Dami... more ... REVIEW B 75, 125203 2007 Germanium diffusion mechanisms in silicon from first principles Damien Caliste, Pascal Pochet, Thierry Deutsch, and ... All three of them have been studied in pure silicon through first-principles calculations see, eg, Bar-Yam and Joannopoulos,21 Bl? ...
Physical Review B, 2011
... Emmanuel Arras, Damien Caliste, Thierry Deutsch, Frédéric Lançon, and Pascal Pochet* Laborato... more ... Emmanuel Arras, Damien Caliste, Thierry Deutsch, Frédéric Lançon, and Pascal Pochet* Laboratoire de Simulation Atomistique (L Sim), SP2M, INAC, CEA-UJF, F-38054 Grenoble Cedex 9, France (Received 17 September 2010; revised manuscript received 23 December ...
Microscopy and Microanalysis, 2010
ABSTRACT Physical Sciences SymposiaCorrelation between Atomic Structure and Superglide of an Inco... more ABSTRACT Physical Sciences SymposiaCorrelation between Atomic Structure and Superglide of an Incommensurate Grain Boundary in AuArticle author querydahmen u [PubMed] [Google Scholar]radetic t [PubMed] [Google Scholar]ye j [PubMed] [Google Scholar]minor a [PubMed] [Google Scholar]caliste d [PubMed] [Google Scholar]lancon f [PubMed] [Google Scholar]U Dahmena1, T Radetica1, J Yea1, AM Minora1, D Calistea2 and F Lancona2a1 Lawrence Berkeley National Laboratory
Journal of Physics: Conference Series, 2010
ABSTRACT The atomic structure of an incommensurate (001)/(110) Si grain boundary (GB) or 90° Si G... more ABSTRACT The atomic structure of an incommensurate (001)/(110) Si grain boundary (GB) or 90° Si GB has been studied by transmission electron microscopy (TEM) and refined by atomistic simulations (Stillinger-Weber potential). Samples were made by bonding one (001) Si wafer with one (110) Si wafer and carefully orienting the 2 wafers in order that they have a common [10] direction. In the interfacial direction perpendicular to [10], the [110]I direction of grain I is parallel to the [001]II direction of grain II and, as the ratio of these 2 vectors is , it is impossible to find 2 integers n and m such that n[110]I=m[001]II. The structure is incommensurate in this direction. Z-contrast images obtained in an FEI-Titan microscope equipped with a probe Cs-corrector easily resolve the Si dumb-bells in the two grains and allow us to determine the complex atomic structures of the interface. On the other hand, near on-axis high resolution TEM images obtained in a JEOL 4000EX microscope are very efficient to analyse the long range order of the interface.
Journal of Non-Crystalline Solids, 1990
structures can be built by 3D cross sections through 3D atomic motifs in a 6D space. By numerical... more structures can be built by 3D cross sections through 3D atomic motifs in a 6D space. By numerical simulation, we study the stability of a monoatomic model and of an AIMnSi model with interatomic pair potentials. Because all site environments are inequivalent, atoms move from their initial positions. The resulting structures can be related to modifications of the atomic motifs.
Journal of Magnetism and Magnetic Materials, 2009
FePt thin layers have been epitaxied either on Pt(0 0 1) or on MgO(0 0 1) substrates, and magneti... more FePt thin layers have been epitaxied either on Pt(0 0 1) or on MgO(0 0 1) substrates, and magnetically characterized using extraordinary Hall effect magnetometry and magnetic force microscopy. The coercivity originates in both cases from the pinning of domain walls on structural defects. Whereas the coercivity increases with the FePt layer thickness in FePt/Pt samples, it decreases in FePt/MgO samples. This discrepancy is explained on the basis of structural observations, and of atomistic simulations of magnetic domain wall pinning.
Journal of Applied Physics, 2009
The structure of domain walls delimiting magnetic bubbles in L10 FePd thin layers is described on... more The structure of domain walls delimiting magnetic bubbles in L10 FePd thin layers is described on the basis of Lorentz transmission electron microscopy (LTEM) and multiscale magnetic simulations. Images obtained by high resolution LTEM show the existence of magnetization reversal areas inside domain walls, called vertical Bloch lines (VBL). Combining these observations and multiscale simulations on various geometries, we can identify the structure of these VBL, notably the presence or not of magnetic singularities.
Applied Physics Letters, 2008
We present a multiscale analysis on stress enhanced vacancy-mediated diffusion in strained Si tha... more We present a multiscale analysis on stress enhanced vacancy-mediated diffusion in strained Si that explicitly includes the Jahn–Teller structural distortion around vacancies. The resulting anisotropy combined with biaxial deformations applied to (100)-oriented films lead to an orientational dependency of the vacancy formation energy. At finite temperatures, it results in a strong entropy effect when thermal activation allows occupancy of high energy defect states. Kinetic Lattice Monte Carlo simulations reveal that the effective activation energy is a strongly nonlinear function of strain at small deformations. At larger deformations, it becomes linear where as the occupancy of the excited states becomes insignificant.
Journal de Physique I, 1994
... On choosing a proper basis for deternùning structures of quasicrystals Frédéric Lançon (),Luc... more ... On choosing a proper basis for deternùning structures of quasicrystals Frédéric Lançon (),Luc Billard (), Sergei Burkov (>*) and Marc de Boissieu () ( Département de Recherche Fondamentale sur la Matière Condensée, CEA, SP2M /MP, 38054 ...
Physical review. B, Condensed matter, Jan 15, 1988
The present extended x-ray-absorption fine-structure (EXAFS) investigation aims at determining th... more The present extended x-ray-absorption fine-structure (EXAFS) investigation aims at determining the atom-pair displacements on a local scale in the Au1-xNix system, for the three types of pairs Au-Au, Au-Ni, and Ni-Ni. X-ray-absorption spectra have been obtained above both edges (Au L3 and Ni K), over the whole composition range. For the purpose of the separation of the Au and Ni
EMC 2008 14th European Microscopy Congress 1–5 September 2008, Aachen, Germany, 2008
ABSTRACT A non-symmetric and non-periodic (001)/(110) Si grain boundary (GB) has been experimenta... more ABSTRACT A non-symmetric and non-periodic (001)/(110) Si grain boundary (GB) has been experimental studied by transmission electron microscopy (TEM) and its atomic structure refined by atomic simulation. The (001)/(110) Si grain boundary was made by bonding together two different 4” Si wafers, having respectively (001) and (110) surfaces. The wafers were carefully aligned in order that they have a common in-plane [110] direction. In the interface perpendicular to [110], the [110] direction of the first grain is then parallel to the [001] direction of the second grain (figure 2). As the ratio of the norms of these two directions is equal to Ö2 \sqrt 2 , it is mathematically impossible to have a common period along these directions and the GB is said to be incommensurate [1].
Journal de Physique I, 1997
Physical Review E, 1999
... ERWAN ADAM, LUC BILLARD, AND FRÉDÉRIC LANC¸ON ... This number corre-sponds to the number of c... more ... ERWAN ADAM, LUC BILLARD, AND FRÉDÉRIC LANC¸ON ... This number corre-sponds to the number of configurations j really connected to i. For each of the following four algorithms, we have car-ried out five numerical simulations corresponding to five different random ...
Physical Review B, 2008
A multiscale method that couples classical Heisenberg model to micromagnetics in a unified formal... more A multiscale method that couples classical Heisenberg model to micromagnetics in a unified formalism is presented. It is based on a multiresolution adaptive finite difference mesh, which ensures significant reduction of the number of variables and computation time with respect to either atomistic or micromagnetic simulations, together with a precise description of the modeled system where necessary. The hierarchical structure
Physical Review B - Condensed Matter and Materials Physics, 2010
We report on the structural properties of Ge1−xM nx layers grown by molecular beam epitaxy. In th... more We report on the structural properties of Ge1−xM nx layers grown by molecular beam epitaxy. In these layers, nanocolumns with a high Mn content are embedded in an almost-pure Ge matrix. We have used grazing-incidence X-ray scattering, atomic force and transmission electron microscopy to study the structural properties of the columns. We demonstrate how the elastic deformation of the matrix (as calculated using atomistic simulations) around the columns, as well as the average inter-column distance can account for the shape of the diffusion around Bragg peaks.
Thin Solid Films, 2010
We compare here the different oxidization protocols that can be used to generate an SiO2/Si inter... more We compare here the different oxidization protocols that can be used to generate an SiO2/Si interface. All these protocols are based on molecular dynamics at high temperature but differ by the way the oxygen atoms are incorporated one-by-one. When they are inserted between two neighbouring Si atoms, forming one of the Si–Si pair closest to the surface, the silicon oxide
Surface Science, 2002
Grazing-incidence X-ray diffraction data are combined with energy-minimization calculations to an... more Grazing-incidence X-ray diffraction data are combined with energy-minimization calculations to analyse the atomic structure of the Al-rich (3 ffiffi ffi 3 p  3 ffiffi ffi 3 p )R30°reconstructed surface of sapphire a-Al 2 O 3 ð0 0 0 1Þ. The experiments on the BM32 beamline of the ESRF provide the non-integer-order diffraction intensities and, after Fourier transform, an incomplete Patterson map. The computer simulations are implemented to obtain structural information from this map. In the simulations, the interactions between the Al overlayer atoms were described with the Sutton-Chen potential and the interactions between the overlayer and the sapphire substrate with a laterally modulated Lennard-Jones potential. We have shown that the hexagonal reconstructed unit cell is composed of triangles where the two layers of Al adatoms are FCC(1 1 1) ordered whereas between the triangles the stacking is FCC(0 0 1). Ó
Physical Review Letters, 1990
The equations of the smoothening dynamics of a crystal surface below the roughening transition ar... more The equations of the smoothening dynamics of a crystal surface below the roughening transition are written in the case of evaporation dynamics. It is assumed that only ledges separating smooth planes are mobile. The equations are applied to the classical experiment in which the decay of parallel grooves is studied. The formation of facets, which has been observed, is argued
Physical Review Letters, 2003
An in-plane perpendicular magnetic coupling between Ni 80 Fe 20 and Co has been found in NiFe=NiO... more An in-plane perpendicular magnetic coupling between Ni 80 Fe 20 and Co has been found in NiFe=NiO=Co trilayers for a NiO thickness ranging from 4 to 25 nm by magneto-optical Kerr effect and x-ray magnetic circular dichroism measurements. In the easy magnetization direction of the Co layer, the Co coercive field H C increases when the thickness of the NiO layer t NiO increases. Because of the coupling, H C is always larger than for NiO=Co bilayers with the same thicknesses. The saturation field of the NiFe layer H S decreases when t NiO increases, indicating a weakening of the coupling. Numerical simulations show that the presence of interface roughness combined with a small value of the NiO anisotropy can explain the observed 90 coupling.
Physical Review B, 2007
... REVIEW B 75, 125203 2007 Germanium diffusion mechanisms in silicon from first principles Dami... more ... REVIEW B 75, 125203 2007 Germanium diffusion mechanisms in silicon from first principles Damien Caliste, Pascal Pochet, Thierry Deutsch, and ... All three of them have been studied in pure silicon through first-principles calculations see, eg, Bar-Yam and Joannopoulos,21 Bl? ...
Physical Review B, 2011
... Emmanuel Arras, Damien Caliste, Thierry Deutsch, Frédéric Lançon, and Pascal Pochet* Laborato... more ... Emmanuel Arras, Damien Caliste, Thierry Deutsch, Frédéric Lançon, and Pascal Pochet* Laboratoire de Simulation Atomistique (L Sim), SP2M, INAC, CEA-UJF, F-38054 Grenoble Cedex 9, France (Received 17 September 2010; revised manuscript received 23 December ...
Microscopy and Microanalysis, 2010
ABSTRACT Physical Sciences SymposiaCorrelation between Atomic Structure and Superglide of an Inco... more ABSTRACT Physical Sciences SymposiaCorrelation between Atomic Structure and Superglide of an Incommensurate Grain Boundary in AuArticle author querydahmen u [PubMed] [Google Scholar]radetic t [PubMed] [Google Scholar]ye j [PubMed] [Google Scholar]minor a [PubMed] [Google Scholar]caliste d [PubMed] [Google Scholar]lancon f [PubMed] [Google Scholar]U Dahmena1, T Radetica1, J Yea1, AM Minora1, D Calistea2 and F Lancona2a1 Lawrence Berkeley National Laboratory
Journal of Physics: Conference Series, 2010
ABSTRACT The atomic structure of an incommensurate (001)/(110) Si grain boundary (GB) or 90° Si G... more ABSTRACT The atomic structure of an incommensurate (001)/(110) Si grain boundary (GB) or 90° Si GB has been studied by transmission electron microscopy (TEM) and refined by atomistic simulations (Stillinger-Weber potential). Samples were made by bonding one (001) Si wafer with one (110) Si wafer and carefully orienting the 2 wafers in order that they have a common [10] direction. In the interfacial direction perpendicular to [10], the [110]I direction of grain I is parallel to the [001]II direction of grain II and, as the ratio of these 2 vectors is , it is impossible to find 2 integers n and m such that n[110]I=m[001]II. The structure is incommensurate in this direction. Z-contrast images obtained in an FEI-Titan microscope equipped with a probe Cs-corrector easily resolve the Si dumb-bells in the two grains and allow us to determine the complex atomic structures of the interface. On the other hand, near on-axis high resolution TEM images obtained in a JEOL 4000EX microscope are very efficient to analyse the long range order of the interface.
Journal of Non-Crystalline Solids, 1990
structures can be built by 3D cross sections through 3D atomic motifs in a 6D space. By numerical... more structures can be built by 3D cross sections through 3D atomic motifs in a 6D space. By numerical simulation, we study the stability of a monoatomic model and of an AIMnSi model with interatomic pair potentials. Because all site environments are inequivalent, atoms move from their initial positions. The resulting structures can be related to modifications of the atomic motifs.
Journal of Magnetism and Magnetic Materials, 2009
FePt thin layers have been epitaxied either on Pt(0 0 1) or on MgO(0 0 1) substrates, and magneti... more FePt thin layers have been epitaxied either on Pt(0 0 1) or on MgO(0 0 1) substrates, and magnetically characterized using extraordinary Hall effect magnetometry and magnetic force microscopy. The coercivity originates in both cases from the pinning of domain walls on structural defects. Whereas the coercivity increases with the FePt layer thickness in FePt/Pt samples, it decreases in FePt/MgO samples. This discrepancy is explained on the basis of structural observations, and of atomistic simulations of magnetic domain wall pinning.
Journal of Applied Physics, 2009
The structure of domain walls delimiting magnetic bubbles in L10 FePd thin layers is described on... more The structure of domain walls delimiting magnetic bubbles in L10 FePd thin layers is described on the basis of Lorentz transmission electron microscopy (LTEM) and multiscale magnetic simulations. Images obtained by high resolution LTEM show the existence of magnetization reversal areas inside domain walls, called vertical Bloch lines (VBL). Combining these observations and multiscale simulations on various geometries, we can identify the structure of these VBL, notably the presence or not of magnetic singularities.
Applied Physics Letters, 2008
We present a multiscale analysis on stress enhanced vacancy-mediated diffusion in strained Si tha... more We present a multiscale analysis on stress enhanced vacancy-mediated diffusion in strained Si that explicitly includes the Jahn–Teller structural distortion around vacancies. The resulting anisotropy combined with biaxial deformations applied to (100)-oriented films lead to an orientational dependency of the vacancy formation energy. At finite temperatures, it results in a strong entropy effect when thermal activation allows occupancy of high energy defect states. Kinetic Lattice Monte Carlo simulations reveal that the effective activation energy is a strongly nonlinear function of strain at small deformations. At larger deformations, it becomes linear where as the occupancy of the excited states becomes insignificant.