Measuring quantum decoherence and entanglement in attosecond photoemission
The PhD project is centered on the advanced study of attosecond photoemission dynamics. The objective is to access in real time decoherence processes induced, e.g., by electron-ion quantum entanglement. To that aim, the young researcher will develop attosecond spectroscopy techniques making use of a new high repetition rate Ytterbium laser.
Detailed summary :
In recent years, there has been spectacular progress in the generation of attosecond (1 as=10-18 s) pulses, awarded the 2023 Nobel Prize [1]. These ultrashort pulses are generated from the strong nonlinear interaction of short intense laser pulses with gas jets [2]. They have opened new prospects for the exploration of matter at the electron intrinsic timescale. Attosecond spectroscopy allows studying in real time the quantum process of photoemission and shooting the 3D movie of the electron wavepacket ejection [3, 4]. However, these studies were confined to fully coherent dynamics by the lack of experimental and theoretical tools to deal with decoherence and quantum entanglement. Recently, two techniques have been proposed to perform a quantum tomography of the photoelectron in its final asymptotic state [5, 6].
The objective of the PhD project is to develop attosecond spectroscopy to access the full time evolution of decoherence and entanglement during the photoemission process. Quantum tomographic techniques will be implemented on the ATTOLab laser platform (https://iramis.cea.fr/en/lidyl/atto/attolab-platform/) using a new Ytterbium laser source. This novel laser technology is emerging, with stability 5 times higher and repetition rate 10 times higher than the current Titanium:Sapphire technology. These new capabilities represent a breakthrough for the field and allow, e.g., charged particle coincidence techniques, to study the dynamics of photoemission and quantum entanglement with unprecedented precision.
This PhD project is performed in the frame of a recently funded European Network QU-ATTO (https://quatto.eu/), providing an advanced training to 15 young researchers, and opening many opportunities of joint work with European laboratories. In particular, strong collaborations are already ongoing with the groups of Prof. Anne L’Huillier in Lund, and Prof. Giuseppe Sansone in Freiburg. Due to the Mobility Rule, candidates must not have resided (work, studies) in France for more than 12 months since August 2022.
The student will receive solid training in ultrafast optics, atomic and molecular physics, attosecond science, quantum optics, and will acquire a broad mastery of XUV and charged-particle spectroscopy techniques.
References :
[1] https://www.nobelprize.org/prizes/physics/2023/summary/
[2] Y. Mairesse, et al., Science 302, 1540 (2003)
[3] V. Gruson, et al., Science 354, 734 (2016)
[4] A. Autuori, et al., Science Advances 8, eabl7594 (2022)
[5] C. Bourassin-Bouchet, et al., Phys. Rev. X 10, 031048 (2020)
[6] H. Laurell, et al., Nature Photonics, https://doi.org/10.1038/s41566-024-01607-8 (2025)
study of lithium isotopes separation by laser
This thesis concerns the study of different ways of separating lithium isotopes by laser. The work will be conducted both theoretically and experimentally. The objective is to determine an optimal way as well as its performances.
Molecular Dynamics Simulation of Plutonium(IV) in Solution
With the revival of nuclear power in France, the CEA is playing a key role in the nuclear industry of the future. In this context, engineers and researchers are mobilised to meet the growing needs of this industry. Plutonium is a key element in the nuclear fuel cycle. Acquiring molecular data is crucial to optimising and rationalising the mechanisms involved in separating this element.
Plutonium(IV) is one of the most common cationic forms in the nuclear fuel cycle. Its study by theoretical chemistry presents difficulties both in ab initio modelling (occupied f-block orbitals) and in classical atomistic simulations. In classical molecular dynamics simulation, the models necessarily require the addition of the polarisation effect, and sometimes even the addition of charge transfer, in order to reproduce the system's behaviour correctly. As a result, classical simulations containing plutonium (IV) are almost completely absent from the scientific literature. In addition, the speciation of this cation is sensitive to the acidity of the medium, which has to be taken into account in the simulations, adding a further difficulty.
The aim of this thesis is to use molecular dynamics (classical and ab initio) to simulate solutions containing plutonium, taking into account the effect of acidity. The PhD student will be faced with two main issues: the choice or development of a force field for the Pu4+ cation, and the design of a method for including acidity in the solutions. A crucial step in the process will be to compare the results with the available experimental data in order to conclude on the ability of the models to reproduce the experimental data. This thesis will be carried out in a multidisciplinary laboratory, combining experimental chemistry and theoretical modelling, while conducting both applied and fundamental research.
Atomistic investigation of the diffusion of small xenon clusters in the metallic nuclear fuel UMo
This project is centered on the application of atomistic methods in order to investigate the stability and diffusion of intra-granular xenon clusters within the metallic nuclear fuel UMo.
Uranium – molybdenum alloys UMo present excellent thermal properties and a good uranium density. For those reasons, they are considered as nuclear fuel candidates for research reactors. It is therefore crucial to deploy new computational methodologies in order to investigate the evolution of their thermophysical properties under irradiation conditions.
During this PhD project, you will be in charge of validating (and, if necessary, recalibrating) the atomistic computational models for UMo that have been published in the literature. You will then apply those to the simulation of the stability and diffusion of small xenon clusters (typically up to 5 xenon atoms) within UMo crystals. Those computations will be performed leveraging accelerated molecular dynamics methods, and systematically compared to the results obtained for the reference nuclear fuel UO2. The results will also be analyzed by comparison to experimental measurements performed within the department, as well as used as reference data for larger-scale nuclear fuel performance codes. The results of your research will be published in scientific journals, and you are expected to attend international conferences to present your findings.
Those different investigations will allow you to acquire a set of competences applicable to many areas of materials science: ab initio calculations, machine-learning adjustment of interatomic potentials, classical and accelerated molecular dynamics, as well as many elements of statistical physics and condensed matter physics, which are among the areas of expertise of the PhD advisors.
The PhD will be based in the Fuel Behavior Modeling Laboratory (IRESNE Institute, CEA Cadarache), a dynamic research environment within which you will have the opportunity to interact with other PhD students. You will also benefit from a rich collaborative network (experimental researchers from the department, ISAS Institute at CEA Saclay, CINAM Laboratory in Marseille), that will allow you to become a member of the nuclear materials research community.
Behavior of nanocavities under mechanical loading: from understanding physical mechanisms to homogenizing nanoporous materials
Nanocavities - typically a few nm to a few tens of nm in size - are often observed in metals, for example in high-temperature applications due to the condensation of vacancies or in metal alloys used in nuclear reactors due to irradiation. The presence of these nanocavities degrades the mechanical behaviour of materials and contributes to fracture. It is therefore necessary to determine the physical mechanisms associated with the behaviour of these nanocavities under mechanical loading and to obtain homogenised models describing the macroscopic behaviour of these nanoporous materials. The results available in the literature remain limited to date, particularly with regard to the representativeness of the simulations carried out and the models proposed for the applications of interest. This includes for example considering crystal defects surrounding the cavities, the effect of cyclic loading and the localisation of nanocavities at grain boundaries. The objectives of this thesis are therefore to determine the behaviour of nanocavities under mechanical loading and the associated physical mechanisms by considering realistic situations with respect to applications, to develop physically-based analytical models to describe the behaviour of nanocavities under mechanical loading, and finally to propose homogenised models adapted to nanocavities that can be used to simulate the failure by growth and coalescence of cavities. The targeted applications are those related to metal alloys under irradiation, but the elements of understanding obtained and the models developed could be used in a broader context. In order to achieve these objectives, Molecular Dynamics (MD) simulations will be performed, analysed from the elastic theory of dislocations and used to propose relevant homogenised models for nanoporous materials.