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Excited-State Dynamics with the Exact Factorizat ... (No replies)

federica.agostini
6 years ago
federica.agostini 6 years ago

Dear colleagues,

We are looking for candidates for a 3-year PhD position starting on October 1st, 2018 at the University Paris-Sud (Orsay, south of Paris, France), at Laboratoire de Chimie Physique. We would like to ask for your help in advertising this position in the fields of chemical physics and theoretical chemistry. 

The topic will be the study of excited-state dynamics, in particular photo-induced processes and dynamics at conical intersections. We aim at developing the exact factorization of the electron-nuclear wavefunction [1-3] and trajectory-based quantum-classical algorithms [4, 5] to study the excited-state dynamics of photo-excited molecules.

The selected candidate(s) will be examined in April 2018 by the doctoral school https://www.universite-paris-saclay.fr/en/education/doctorate/chemical-sciences-molecules-materials-instrumentation-and-biosystems-2mib#l-ecole-doctorale.

Please find in attachment a detail description of the position.

[1] A. Abedi, N. T. Maitra, E. K. U. Gross, Phys. Rev. Lett. 105 (2010) 123002.

[2] A. Abedi, F. Agostini, Y. Suzuki, E. K. U. Gross, Phys. Rev. Lett. 110 (2013) 263001.

[3] B. F. E. Curchod, F. Agostini, J. Phys. Chem. Lett. 8 (2017) 831.

[4] S. K. Min, F. Agostini, E. K. U. Gross, Phys. Rev. Lett. 115 (2015) 073001.

[5] S. K. Min, F. Agostini, I. Tavernelli and E. K. U. Gross, J. Phys. Chem. Lett. 8 (2017) 3048.

Thank you for your help.

Kind regards,

Federica Agostini

PhDposition_Agostini.pdf



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Ab initio (from electronic structure) calculation of complex processes in materials